1,6-bis[4,4-dimethyl-6-oxidanylidene-2-[(phenylmethyl)amino]cyclohexen-1-yl]hexane-1,6-dione

Systemtic Name: 1,6-bis[4,4-dimethyl-6-oxidanylidene-2-[(phenylmethyl)amino]cyclohexen-1-yl]hexane-1,6-dione Openeye Name: 1,6-bis[2-(benzylamino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]hexane-1,6-dione CAS Name: 1,6-bis[4,4-dimethyl-6-oxo-2-[(phenylmethyl)amino]-1-cyclohexenyl]hexane-1,6-dione IUPAC Name: 1,6-bis[2-(benzylamino)-4,4-dimethyl-6-oxocyclohexen-1-yl]hexane-1,6-dione Traditional Name: 1,6-bis[2-(benzylamino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]hexane-1,6-dione Formula: C36H44N2O4 MolecularWeight: 568.74556

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=O)CCCCC(=O)C2=C(CC(CC2=O)(C)C)NCC3=CC=CC=C3)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)CCCCC(=O)C2=C(CC(CC2=O)(C)C)NCC3=CC=CC=C3)NCC4=CC=CC=C4)C

InChI

InChI=1S/C36H44N2O4/c1-35(2)19-27(37-23-25-13-7-5-8-14-25)33(31(41)21-35)29(39)17-11-12-18-30(40)34-28(20-36(3,4)22-32(34)42)38-24-26-15-9-6-10-16-26/h5-10,13-16,37-38H,11-12,17-24H2,1-4H3