(4-methoxyphenyl)methyl 4-(2-cyclohexyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 4-(2-cyclohexyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylate Openeye Name: (4-methoxyphenyl)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 (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)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 p-anisyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)N2CCN(CC2)C3=CC4=C(CN(C4=O)C5CCCCC5)C=C3

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)N2CCN(CC2)C3=CC4=C(CN(C4=O)C5CCCCC5)C=C3

InChI

InChI=1S/C27H33N3O4/c1-33-24-11-7-20(8-12-24)19-34-27(32)29-15-13-28(14-16-29)23-10-9-21-18-30(26(31)25(21)17-23)22-5-3-2-4-6-22/h7-12,17,22H,2-6,13-16,18-19H2,1H3