2-[4-[2-[(3-methoxyphenyl)amino]-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[2-[(3-methoxyphenyl)amino]-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-[2-(3-methoxyanilino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-[2-(3-methoxyanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-[2-(3-methoxyanilino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-keto-4-[6-keto-2-(m-anisidino)-4,4-dimethyl-cyclohexen-1-yl]butyl]isoindoline-1,3-quinone Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)OC)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)NC4=CC(=CC=C4)OC)C

InChI

InChI=1S/C27H28N2O5/c1-27(2)15-21(28-17-8-6-9-18(14-17)34-3)24(23(31)16-27)22(30)12-7-13-29-25(32)19-10-4-5-11-20(19)26(29)33/h4-6,8-11,14,28H,7,12-13,15-16H2,1-3H3