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

Systemtic Name: 3-[2-(6,6-dimethyl-4-oxidanylidene-1-propanoyl-5,7-dihydroindazol-3-yl)ethyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one Openeye Name: 3-[2-(6,6-dimethyl-4-oxo-1-propanoyl-5,7-dihydroindazol-3-yl)ethyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one CAS Name: 3-[2-[6,6-dimethyl-4-oxo-1-(1-oxopropyl)-5,7-dihydroindazol-3-yl]ethyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one IUPAC Name: 3-[2-(6,6-dimethyl-4-oxo-1-propanoyl-5,7-dihydroindazol-3-yl)ethyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one Traditional Name: 3-[2-(4-keto-6,6-dimethyl-1-propionyl-5,7-dihydroindazol-3-yl)ethyl]-6-phenyl-6,7-dihydro-5H-indoxazen-4-one Formula: C27H29N3O4 MolecularWeight: 459.53686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C2=C(C(=O)CC(C2)(C)C)C(=N1)CCC3=NOC4=C3C(=O)CC(C4)C5=CC=CC=C5

Isomeric SMILES

CCC(=O)N1C2=C(C(=O)CC(C2)(C)C)C(=N1)CCC3=NOC4=C3C(=O)CC(C4)C5=CC=CC=C5

InChI

InChI=1S/C27H29N3O4/c1-4-24(33)30-20-14-27(2,3)15-22(32)25(20)18(28-30)10-11-19-26-21(31)12-17(13-23(26)34-29-19)16-8-6-5-7-9-16/h5-9,17H,4,10-15H2,1-3H3