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

Systemtic Name: 1-[1-(1H-imidazol-5-yl)-2-methyl-1-oxidanyl-propyl]-2-propyl-1H-benzo[e]isoindol-3-one Openeye Name: 1-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methyl-propyl]-2-propyl-1H-benzo[e]isoindol-3-one CAS Name: 1-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methylpropyl]-2-propyl-1H-benzo[e]isoindol-3-one IUPAC Name: 1-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methylpropyl]-2-propyl-1H-benzo[e]isoindol-3-one Traditional Name: 1-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methyl-propyl]-2-propyl-1H-benz[e]isoindol-3-one Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C2=C(C1=O)C=CC3=CC=CC=C32)C(C4=CN=CN4)(C(C)C)O

Isomeric SMILES

CCCN1C(C2=C(C1=O)C=CC3=CC=CC=C32)C(C4=CN=CN4)(C(C)C)O

InChI

InChI=1S/C22H25N3O2/c1-4-11-25-20(22(27,14(2)3)18-12-23-13-24-18)19-16-8-6-5-7-15(16)9-10-17(19)21(25)26/h5-10,12-14,20,27H,4,11H2,1-3H3,(H,23,24)