[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate

Systemtic Name: [4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate Openeye Name: (3-benzyl-4-methyl-2-oxo-chromen-7-yl) 4-(benzyloxycarbonylaminomethyl)cyclohexanecarboxylate CAS Name: 4-(phenylmethoxycarbonylaminomethyl)-1-cyclohexanecarboxylic acid [4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-4-methyl-2-oxochromen-7-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate Traditional Name: 4-(benzyloxycarbonylaminomethyl)cyclohexanecarboxylic acid (3-benzyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C33H33NO6 MolecularWeight: 539.61822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C3CCC(CC3)CNC(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C3CCC(CC3)CNC(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C33H33NO6/c1-22-28-17-16-27(19-30(28)40-32(36)29(22)18-23-8-4-2-5-9-23)39-31(35)26-14-12-24(13-15-26)20-34-33(37)38-21-25-10-6-3-7-11-25/h2-11,16-17,19,24,26H,12-15,18,20-21H2,1H3,(H,34,37)