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

Systemtic Name: 2-[1-azanyl-3-(4-oxidanylidene-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[1-amino-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[1-amino-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[1-amino-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[1-amino-3-(4-keto-6,7-dihydro-5H-indoxazen-3-yl)propylidene]-5-phenyl-cyclohexane-1,3-quinone Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)C1)C(=NO2)CCC(=C3C(=O)CC(CC3=O)C4=CC=CC=C4)N

Isomeric SMILES

C1CC2=C(C(=O)C1)C(=NO2)CCC(=C3C(=O)CC(CC3=O)C4=CC=CC=C4)N

InChI

InChI=1S/C22H22N2O4/c23-15(9-10-16-22-17(25)7-4-8-20(22)28-24-16)21-18(26)11-14(12-19(21)27)13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12,23H2