2-butanoyl-3-[[2-[(2-butanoyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]phenyl]amino]-4,5,5-trimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-butanoyl-3-[[2-[(2-butanoyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]phenyl]amino]-4,5,5-trimethyl-cyclohex-2-en-1-one Openeye Name: 2-butanoyl-3-[2-[(2-butanoyl-5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]anilino]-4,5,5-trimethyl-cyclohex-2-en-1-one CAS Name: 3-[2-[[5,5-dimethyl-3-oxo-2-(1-oxobutyl)-1-cyclohexenyl]amino]anilino]-4,5,5-trimethyl-2-(1-oxobutyl)-1-cyclohex-2-enone IUPAC Name: 2-butanoyl-3-[2-[(2-butanoyl-5,5-dimethyl-3-oxocyclohexen-1-yl)amino]anilino]-4,5,5-trimethylcyclohex-2-en-1-one Traditional Name: 2-butyryl-3-[2-[(2-butyryl-3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]anilino]-4,5,5-trimethyl-cyclohex-2-en-1-one Formula: C31H42N2O4 MolecularWeight: 506.67618

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(CC(CC1=O)(C)C)NC2=CC=CC=C2NC3=C(C(=O)CC(C3C)(C)C)C(=O)CCC

Isomeric SMILES

CCCC(=O)C1=C(CC(CC1=O)(C)C)NC2=CC=CC=C2NC3=C(C(=O)CC(C3C)(C)C)C(=O)CCC

InChI

InChI=1S/C31H42N2O4/c1-8-12-23(34)27-22(16-30(4,5)17-25(27)36)32-20-14-10-11-15-21(20)33-29-19(3)31(6,7)18-26(37)28(29)24(35)13-9-2/h10-11,14-15,19,32-33H,8-9,12-13,16-18H2,1-7H3