CCOC(=O)CN(CC1=C(C=CC(=C1)Cl)N)C(=O)OC(C)(C)C
الاسم: ethyl 2-[(2-amino-5-chlorophenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetate
SMILES: CCOC(=O)CN(CC1=C(C=CC(=C1)Cl)N)C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C16H23ClN2O4
Molecular weight
342.82
Exact mass
342.1346
XLogP
3.22
TPSA
81.86
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
89.14

Supplementary Information

InChIKey: IYOLVGMYGBKEBT-UHFFFAOYSA-N
مرادفات
SCHEMBL2325513IYOLVGMYGBKEBT-UHFFFAOYSA-N[(2-amino-5-chloro-benzyl)-tert-butoxycarbonyl-amino]-acetic acid ethyl ester[(2-amino-5-chloro-benzyl)-tert-butoxycarbonyl-amino]acetic acid ethyl ester
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