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

Systemtic Name: 2-[3-(4-oxidanylidene-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)-1-(prop-2-enylamino)propylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[1-(allylamino)-3-(4-oxo-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[3-(4-oxo-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)-1-(prop-2-enylamino)propylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[3-(4-oxo-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)-1-(prop-2-enylamino)propylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[1-(allylamino)-3-(4-keto-6-phenyl-6,7-dihydro-5H-indoxazen-3-yl)propylidene]-5-phenyl-cyclohexane-1,3-quinone Formula: C31H30N2O4 MolecularWeight: 494.5809

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=C1C(=O)CC(CC1=O)C2=CC=CC=C2)CCC3=NOC4=C3C(=O)CC(C4)C5=CC=CC=C5

Isomeric SMILES

C=CCNC(=C1C(=O)CC(CC1=O)C2=CC=CC=C2)CCC3=NOC4=C3C(=O)CC(C4)C5=CC=CC=C5

InChI

InChI=1S/C31H30N2O4/c1-2-15-32-24(30-26(34)16-22(17-27(30)35)20-9-5-3-6-10-20)13-14-25-31-28(36)18-23(19-29(31)37-33-25)21-11-7-4-8-12-21/h2-12,22-23,32H,1,13-19H2