3-[2-(1-butanoyl-4-oxidanylidene-6,7-dihydro-5H-indazol-3-yl)ethyl]-6,6-dimethyl-5,7-dihydro-1,2-benzoxazol-4-one

Systemtic Name: 3-[2-(1-butanoyl-4-oxidanylidene-6,7-dihydro-5H-indazol-3-yl)ethyl]-6,6-dimethyl-5,7-dihydro-1,2-benzoxazol-4-one Openeye Name: 3-[2-(1-butanoyl-4-oxo-6,7-dihydro-5H-indazol-3-yl)ethyl]-6,6-dimethyl-5,7-dihydro-1,2-benzoxazol-4-one CAS Name: 6,6-dimethyl-3-[2-[4-oxo-1-(1-oxobutyl)-6,7-dihydro-5H-indazol-3-yl]ethyl]-5,7-dihydro-1,2-benzoxazol-4-one IUPAC Name: 3-[2-(1-butanoyl-4-oxo-6,7-dihydro-5H-indazol-3-yl)ethyl]-6,6-dimethyl-5,7-dihydro-1,2-benzoxazol-4-one Traditional Name: 3-[2-(1-butyryl-4-keto-6,7-dihydro-5H-indazol-3-yl)ethyl]-6,6-dimethyl-5,7-dihydroindoxazen-4-one Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C2=C(C(=O)CCC2)C(=N1)CCC3=NOC4=C3C(=O)CC(C4)(C)C

Isomeric SMILES

CCCC(=O)N1C2=C(C(=O)CCC2)C(=N1)CCC3=NOC4=C3C(=O)CC(C4)(C)C

InChI

InChI=1S/C22H27N3O4/c1-4-6-19(28)25-15-7-5-8-16(26)20(15)13(23-25)9-10-14-21-17(27)11-22(2,3)12-18(21)29-24-14/h4-12H2,1-3H3