[methoxy(phenyl)methyl] 4-(2-cyclohexyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylate

Systemtic Name: [methoxy(phenyl)methyl] 4-(2-cyclohexyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylate Openeye Name: [methoxy(phenyl)methyl] 4-(2-cyclohexyl-3-oxo-isoindolin-5-yl)piperazine-1-carboxylate CAS Name: 4-(2-cyclohexyl-3-oxo-1H-isoindol-5-yl)-1-piperazinecarboxylic acid [methoxy(phenyl)methyl] ester IUPAC Name: [methoxy(phenyl)methyl] 4-(2-cyclohexyl-3-oxo-1H-isoindol-5-yl)piperazine-1-carboxylate Traditional Name: 4-(2-cyclohexyl-3-keto-isoindolin-5-yl)piperazine-1-carboxylic acid [methoxy(phenyl)methyl] ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1)OC(=O)N2CCN(CC2)C3=CC4=C(CN(C4=O)C5CCCCC5)C=C3

Isomeric SMILES

COC(C1=CC=CC=C1)OC(=O)N2CCN(CC2)C3=CC4=C(CN(C4=O)C5CCCCC5)C=C3

InChI

InChI=1S/C27H33N3O4/c1-33-26(20-8-4-2-5-9-20)34-27(32)29-16-14-28(15-17-29)23-13-12-21-19-30(25(31)24(21)18-23)22-10-6-3-7-11-22/h2,4-5,8-9,12-13,18,22,26H,3,6-7,10-11,14-17,19H2,1H3