2-[3-(6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1,2-benzoxazol-3-yl)-1-pyrrolidin-1-yl-propylidene]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[3-(6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1,2-benzoxazol-3-yl)-1-pyrrolidin-1-yl-propylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[3-(6,6-dimethyl-4-oxo-5,7-dihydro-1,2-benzoxazol-3-yl)-1-pyrrolidin-1-yl-propylidene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[3-(6,6-dimethyl-4-oxo-5,7-dihydro-1,2-benzoxazol-3-yl)-1-(1-pyrrolidinyl)propylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[3-(6,6-dimethyl-4-oxo-5,7-dihydro-1,2-benzoxazol-3-yl)-1-pyrrolidin-1-ylpropylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[3-(4-keto-6,6-dimethyl-5,7-dihydroindoxazen-3-yl)-1-pyrrolidino-propylidene]-5-phenyl-cyclohexane-1,3-quinone Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NO2)CCC(=C3C(=O)CC(CC3=O)C4=CC=CC=C4)N5CCCC5)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NO2)CCC(=C3C(=O)CC(CC3=O)C4=CC=CC=C4)N5CCCC5)C

InChI

InChI=1S/C28H32N2O4/c1-28(2)16-24(33)26-20(29-34-25(26)17-28)10-11-21(30-12-6-7-13-30)27-22(31)14-19(15-23(27)32)18-8-4-3-5-9-18/h3-5,8-9,19H,6-7,10-17H2,1-2H3