Name: 4-(3-carboxyphenyl)piperidine-1-carboxylic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1CCC(c2cccc(C(=O)O)c2)CC1Molecular Processing
Molecular formula
C17H23NO4
Molecular weight
305.37
Exact mass
305.1627
XLogP
3.5
TPSA
66.84
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
83.18
Supplementary Information
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