methyl 4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-1-(prop-2-enoxycarbonylamino)cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-1-(prop-2-enoxycarbonylamino)cyclohexane-1-carboxylate Openeye Name: methyl 1-(allyloxycarbonylamino)-4-[[(2-methoxybenzoyl)amino]methyl]-4-phenyl-cyclohexanecarboxylate CAS Name: 4-[[[(2-methoxyphenyl)-oxomethyl]amino]methyl]-1-[[oxo(prop-2-enoxy)methyl]amino]-4-phenyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[[(2-methoxybenzoyl)amino]methyl]-4-phenyl-1-(prop-2-enoxycarbonylamino)cyclohexane-1-carboxylate Traditional Name: 1-(allyloxycarbonylamino)-4-[(o-anisoylamino)methyl]-4-phenyl-cyclohexanecarboxylic acid methyl ester Formula: C27H32N2O6 MolecularWeight: 480.55278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)(C(=O)OC)NC(=O)OCC=C)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)(C(=O)OC)NC(=O)OCC=C)C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O6/c1-4-18-35-25(32)29-27(24(31)34-3)16-14-26(15-17-27,20-10-6-5-7-11-20)19-28-23(30)21-12-8-9-13-22(21)33-2/h4-13H,1,14-19H2,2-3H3,(H,28,30)(H,29,32)