7-[1-(1H-imidazol-5-yl)-3-methyl-1-oxidanyl-butyl]-2-methyl-1H-benzo[e]isoindol-3-one

Systemtic Name: 7-[1-(1H-imidazol-5-yl)-3-methyl-1-oxidanyl-butyl]-2-methyl-1H-benzo[e]isoindol-3-one Openeye Name: 7-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methyl-butyl]-2-methyl-1H-benzo[e]isoindol-3-one CAS Name: 7-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methylbutyl]-2-methyl-1H-benzo[e]isoindol-3-one IUPAC Name: 7-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methylbutyl]-2-methyl-1H-benzo[e]isoindol-3-one Traditional Name: 7-[1-hydroxy-1-(1H-imidazol-5-yl)-3-methyl-butyl]-2-methyl-1H-benz[e]isoindol-3-one Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC2=C(C=C1)C3=C(C=C2)C(=O)N(C3)C)(C4=CN=CN4)O

Isomeric SMILES

CC(C)CC(C1=CC2=C(C=C1)C3=C(C=C2)C(=O)N(C3)C)(C4=CN=CN4)O

InChI

InChI=1S/C21H23N3O2/c1-13(2)9-21(26,19-10-22-12-23-19)15-5-7-16-14(8-15)4-6-17-18(16)11-24(3)20(17)25/h4-8,10,12-13,26H,9,11H2,1-3H3,(H,22,23)