4-[[[4-(1-pyrrolidin-1-ylcyclohexyl)phenyl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[4-(1-pyrrolidin-1-ylcyclohexyl)phenyl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[4-(1-pyrrolidin-1-ylcyclohexyl)benzoyl]amino]methyl]benzoic acid CAS Name: 4-[[[oxo-[4-[1-(1-pyrrolidinyl)cyclohexyl]phenyl]methyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[4-(1-pyrrolidin-1-ylcyclohexyl)benzoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[4-(1-pyrrolidinocyclohexyl)benzoyl]amino]methyl]benzoic acid Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)O)N4CCCC4

Isomeric SMILES

C1CCC(CC1)(C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)O)N4CCCC4

InChI

InChI=1S/C25H30N2O3/c28-23(26-18-19-6-8-21(9-7-19)24(29)30)20-10-12-22(13-11-20)25(14-2-1-3-15-25)27-16-4-5-17-27/h6-13H,1-5,14-18H2,(H,26,28)(H,29,30)