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

Systemtic Name: 1,4-bis[4,4-dimethyl-6-oxidanylidene-2-(propylamino)cyclohexen-1-yl]butane-1,4-dione Openeye Name: 1,4-bis[4,4-dimethyl-6-oxo-2-(propylamino)cyclohexen-1-yl]butane-1,4-dione CAS Name: 1,4-bis[4,4-dimethyl-6-oxo-2-(propylamino)-1-cyclohexenyl]butane-1,4-dione IUPAC Name: 1,4-bis[4,4-dimethyl-6-oxo-2-(propylamino)cyclohexen-1-yl]butane-1,4-dione Traditional Name: 1,4-bis[6-keto-4,4-dimethyl-2-(propylamino)cyclohexen-1-yl]butane-1,4-dione Formula: C26H40N2O4 MolecularWeight: 444.6068

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)C2=C(CC(CC2=O)(C)C)NCCC

Isomeric SMILES

CCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)C2=C(CC(CC2=O)(C)C)NCCC

InChI

InChI=1S/C26H40N2O4/c1-7-11-27-17-13-25(3,4)15-21(31)23(17)19(29)9-10-20(30)24-18(28-12-8-2)14-26(5,6)16-22(24)32/h27-28H,7-16H2,1-6H3