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

Systemtic Name: 2-[4-[4,4-dimethyl-2-(1-oxidanylbutan-2-ylamino)-6-oxidanylidene-cyclohexen-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-[2-[1-(hydroxymethyl)propylamino]-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-[2-(1-hydroxybutan-2-ylamino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-[2-(1-hydroxybutan-2-ylamino)-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-(1-methylolpropylamino)cyclohexen-1-yl]butyl]isoindoline-1,3-quinone Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=C(C(=O)CC(C1)(C)C)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC(CO)NC1=C(C(=O)CC(C1)(C)C)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C24H30N2O5/c1-4-15(14-27)25-18-12-24(2,3)13-20(29)21(18)19(28)10-7-11-26-22(30)16-8-5-6-9-17(16)23(26)31/h5-6,8-9,15,25,27H,4,7,10-14H2,1-3H3