1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-imidazol-1-yl-butan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-imidazol-1-yl-butan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-imidazol-1-yl-butan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-imidazolyl)-1-butanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-imidazol-1-ylbutan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-imidazol-1-yl-butan-1-one Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCC2=CC=CC=C2C1)N3C=CN=C3

Isomeric SMILES

CC(CC(=O)N1CCC2=CC=CC=C2C1)N3C=CN=C3

InChI

InChI=1S/C16H19N3O/c1-13(19-9-7-17-12-19)10-16(20)18-8-6-14-4-2-3-5-15(14)11-18/h2-5,7,9,12-13H,6,8,10-11H2,1H3