(phenylmethyl) 2-[[4-(aminomethyl)cyclohexyl]carbonylamino]-3-(4-phenylphenyl)propanoate

Systemtic Name: (phenylmethyl) 2-[[4-(aminomethyl)cyclohexyl]carbonylamino]-3-(4-phenylphenyl)propanoate Openeye Name: benzyl 2-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-3-(4-phenylphenyl)propanoate CAS Name: 2-[[[4-(aminomethyl)cyclohexyl]-oxomethyl]amino]-3-(4-phenylphenyl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-3-(4-phenylphenyl)propanoate Traditional Name: 2-[[4-(aminomethyl)cyclohexanecarbonyl]amino]-3-(4-phenylphenyl)propionic acid benzyl ester Formula: C30H34N2O3 MolecularWeight: 470.60256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)C(=O)NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1CN)C(=O)NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C30H34N2O3/c31-20-23-13-17-27(18-14-23)29(33)32-28(30(34)35-21-24-7-3-1-4-8-24)19-22-11-15-26(16-12-22)25-9-5-2-6-10-25/h1-12,15-16,23,27-28H,13-14,17-21,31H2,(H,32,33)