CC(C1=CC=CC=C1)N2CC(CC2=O)(C)NC(=O)OC(C)(C)C
الاسم: tert-butyl N-[(3S)-3-methyl-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl]carbamate
SMILES: CC(C1=CC=CC=C1)N2CC(CC2=O)(C)NC(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C18H26N2O3
Molecular weight
318.42
Exact mass
318.1943
XLogP
3.26
TPSA
58.64
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
88.96

Supplementary Information

InChIKey: XEKFNIGQPOCQCV-ACJLOTCBSA-N
مرادفات
XEKFNIGQPOCQCV-ACJLOTCBSA-Ntert-Butyl {(3S)-3-methyl-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidin-3-yl}carbamate
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