methyl 4-[[4-(cyclohexylmethyl)-1-[(4-methoxycarbonylphenyl)carbonylamino]cyclohexyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[4-(cyclohexylmethyl)-1-[(4-methoxycarbonylphenyl)carbonylamino]cyclohexyl]carbamoyl]benzoate Openeye Name: methyl 4-[[4-(cyclohexylmethyl)-1-[(4-methoxycarbonylbenzoyl)amino]cyclohexyl]carbamoyl]benzoate CAS Name: 4-[[[4-(cyclohexylmethyl)-1-[[(4-methoxycarbonylphenyl)-oxomethyl]amino]cyclohexyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(cyclohexylmethyl)-1-[(4-methoxycarbonylbenzoyl)amino]cyclohexyl]carbamoyl]benzoate Traditional Name: 4-[[1-[(4-carbomethoxybenzoyl)amino]-4-(cyclohexylmethyl)cyclohexyl]carbamoyl]benzoic acid methyl ester Formula: C31H38N2O6 MolecularWeight: 534.64322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2(CCC(CC2)CC3CCCCC3)NC(=O)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2(CCC(CC2)CC3CCCCC3)NC(=O)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C31H38N2O6/c1-38-29(36)25-12-8-23(9-13-25)27(34)32-31(18-16-22(17-19-31)20-21-6-4-3-5-7-21)33-28(35)24-10-14-26(15-11-24)30(37)39-2/h8-15,21-22H,3-7,16-20H2,1-2H3,(H,32,34)(H,33,35)