2-[3-(4-oxidanylidene-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)-1-(phenethylamino)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-(phenethylamino)propylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[3-(4-oxo-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)-1-(phenethylamino)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-(phenethylamino)propylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[3-(4-oxo-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)-1-(phenethylamino)propylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[3-(4-keto-6-phenyl-6,7-dihydro-5H-indoxazen-3-yl)-1-(phenethylamino)propylidene]-5-phenyl-cyclohexane-1,3-quinone Formula: C36H34N2O4 MolecularWeight: 558.66616

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=C1ON=C2CCC(=C3C(=O)CC(CC3=O)C4=CC=CC=C4)NCCC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C(CC(=O)C2=C1ON=C2CCC(=C3C(=O)CC(CC3=O)C4=CC=CC=C4)NCCC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C36H34N2O4/c39-31-20-27(25-12-6-2-7-13-25)21-32(40)35(31)29(37-19-18-24-10-4-1-5-11-24)16-17-30-36-33(41)22-28(23-34(36)42-38-30)26-14-8-3-9-15-26/h1-15,27-28,37H,16-23H2