2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methyl-3-nitro-phenyl)acetamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methyl-3-nitrophenyl)acetamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCC3=CC=CC=C3C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCC3=CC=CC=C3C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O3/c1-13-6-7-16(10-17(13)21(23)24)19-18(22)12-20-9-8-14-4-2-3-5-15(14)11-20/h2-7,10H,8-9,11-12H2,1H3,(H,19,22)