1,4-bis[2-(butylamino)-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]butane-1,4-dione

Systemtic Name: 1,4-bis[2-(butylamino)-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]butane-1,4-dione Openeye Name: 1,4-bis[2-(butylamino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]butane-1,4-dione CAS Name: 1,4-bis[2-(butylamino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]butane-1,4-dione IUPAC Name: 1,4-bis[2-(butylamino)-4,4-dimethyl-6-oxocyclohexen-1-yl]butane-1,4-dione Traditional Name: 1,4-bis[2-(butylamino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]butane-1,4-dione Formula: C28H44N2O4 MolecularWeight: 472.65996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)C2=C(CC(CC2=O)(C)C)NCCCC

Isomeric SMILES

CCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)C2=C(CC(CC2=O)(C)C)NCCCC

InChI

InChI=1S/C28H44N2O4/c1-7-9-13-29-19-15-27(3,4)17-23(33)25(19)21(31)11-12-22(32)26-20(30-14-10-8-2)16-28(5,6)18-24(26)34/h29-30H,7-18H2,1-6H3