3-[3-[2-(1-oxidanylbutan-2-ylamino)-6-oxidanylidene-4-phenyl-cyclohexen-1-yl]-3-oxidanylidene-propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one

Systemtic Name: 3-[3-[2-(1-oxidanylbutan-2-ylamino)-6-oxidanylidene-4-phenyl-cyclohexen-1-yl]-3-oxidanylidene-propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one Openeye Name: 3-[3-[2-[1-(hydroxymethyl)propylamino]-6-oxo-4-phenyl-cyclohexen-1-yl]-3-oxo-propyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one CAS Name: 3-[3-[2-(1-hydroxybutan-2-ylamino)-6-oxo-4-phenyl-1-cyclohexenyl]-3-oxopropyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one IUPAC Name: 3-[3-[2-(1-hydroxybutan-2-ylamino)-6-oxo-4-phenylcyclohexen-1-yl]-3-oxopropyl]-6,7-dihydro-5H-1,2-benzoxazol-4-one Traditional Name: 3-[3-keto-3-[6-keto-2-(1-methylolpropylamino)-4-phenyl-cyclohexen-1-yl]propyl]-6,7-dihydro-5H-indoxazen-4-one Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CCC3=NOC4=C3C(=O)CCC4

Isomeric SMILES

CCC(CO)NC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CCC3=NOC4=C3C(=O)CCC4

InChI

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