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

Systemtic Name: 2-[1-(1-oxidanylbutan-2-ylamino)-3-(4-oxidanylidene-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[1-[1-(hydroxymethyl)propylamino]-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[1-(1-hydroxybutan-2-ylamino)-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[1-(1-hydroxybutan-2-ylamino)-3-(4-oxo-6,7-dihydro-5H-1,2-benzoxazol-3-yl)propylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[3-(4-keto-6,7-dihydro-5H-indoxazen-3-yl)-1-(1-methylolpropylamino)propylidene]-5-phenyl-cyclohexane-1,3-quinone Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=C1C(=O)CC(CC1=O)C2=CC=CC=C2)CCC3=NOC4=C3C(=O)CCC4

Isomeric SMILES

CCC(CO)NC(=C1C(=O)CC(CC1=O)C2=CC=CC=C2)CCC3=NOC4=C3C(=O)CCC4

InChI

InChI=1S/C26H30N2O5/c1-2-18(15-29)27-19(11-12-20-26-21(30)9-6-10-24(26)33-28-20)25-22(31)13-17(14-23(25)32)16-7-4-3-5-8-16/h3-5,7-8,17-18,27,29H,2,6,9-15H2,1H3