1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3-nitrophenyl)amino]ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(3-nitrophenyl)amino]ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-nitroanilino)ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-nitroanilino)ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-nitroanilino)ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-nitroanilino)ethanone Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O3/c21-17(11-18-15-6-3-7-16(10-15)20(22)23)19-9-8-13-4-1-2-5-14(13)12-19/h1-7,10,18H,8-9,11-12H2