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

Systemtic Name: 2-[4-[2-[(2-methoxyphenyl)amino]-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-[2-(2-methoxyanilino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-keto-4-[6-keto-4,4-dimethyl-2-(o-anisidino)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=C4OC)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC=C4OC)C

InChI

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