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

Systemtic Name: 2-[1-(butan-2-ylamino)-3-(4-oxidanylidene-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)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-(sec-butylamino)propylidene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[1-(butan-2-ylamino)-3-(4-oxo-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[1-(butan-2-ylamino)-3-(4-oxo-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[3-(4-keto-6-phenyl-6,7-dihydro-5H-indoxazen-3-yl)-1-(sec-butylamino)propylidene]-5-phenyl-cyclohexane-1,3-quinone Formula: C32H34N2O4 MolecularWeight: 510.62336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H34N2O4/c1-3-20(2)33-25(31-27(35)16-23(17-28(31)36)21-10-6-4-7-11-21)14-15-26-32-29(37)18-24(19-30(32)38-34-26)22-12-8-5-9-13-22/h4-13,20,23-24,33H,3,14-19H2,1-2H3