[(6S)-6-methyloctyl] (1R,2R)-2-[1,3-bis(oxidanylidene)naphtho[2,3-f]isoindol-2-yl]cyclohexane-1-carboxylate

Systemtic Name: [(6S)-6-methyloctyl] (1R,2R)-2-[1,3-bis(oxidanylidene)naphtho[2,3-f]isoindol-2-yl]cyclohexane-1-carboxylate Openeye Name: [(6S)-6-methyloctyl] (1R,2R)-2-(1,3-dioxonaphtho[2,3-f]isoindol-2-yl)cyclohexanecarboxylate CAS Name: (1R,2R)-2-(1,3-dioxo-2-naphtho[2,3-f]isoindolyl)-1-cyclohexanecarboxylic acid [(6S)-6-methyloctyl] ester IUPAC Name: [(6S)-6-methyloctyl] (1R,2R)-2-(1,3-dioxonaphtho[2,3-f]isoindol-2-yl)cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-(1,3-diketonaphth[2,3-f]isoindol-2-yl)cyclohexanecarboxylic acid [(6S)-6-methyloctyl] ester Formula: C32H37NO4 MolecularWeight: 499.64048

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCCOC(=O)C1CCCCC1N2C(=O)C3=CC4=CC5=CC=CC=C5C=C4C=C3C2=O

Isomeric SMILES

CC[C@H](C)CCCCCOC(=O)[C@@H]1CCCC[C@H]1N2C(=O)C3=CC4=CC5=CC=CC=C5C=C4C=C3C2=O

InChI

InChI=1S/C32H37NO4/c1-3-21(2)11-5-4-10-16-37-32(36)26-14-8-9-15-29(26)33-30(34)27-19-24-17-22-12-6-7-13-23(22)18-25(24)20-28(27)31(33)35/h6-7,12-13,17-21,26,29H,3-5,8-11,14-16H2,1-2H3/t21-,26+,29+/m0/s1