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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)C2=C(CC(CC2=O)(C)C)NC(C)C

Isomeric SMILES

CC(C)NC1=C(C(=O)CC(C1)(C)C)C(=O)CCC(=O)C2=C(CC(CC2=O)(C)C)NC(C)C

InChI

InChI=1S/C26H40N2O4/c1-15(2)27-17-11-25(5,6)13-21(31)23(17)19(29)9-10-20(30)24-18(28-16(3)4)12-26(7,8)14-22(24)32/h15-16,27-28H,9-14H2,1-8H3