N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-3-nitro-benzamide

Systemtic Name: N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-3-nitro-benzamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-3-nitro-benzamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-3-nitrobenzamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-3-nitrobenzamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-3-nitro-benzamide Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O4/c1-12-3-4-15(10-18(12)22(25)26)19(24)20-17-6-5-14-7-8-21(13(2)23)11-16(14)9-17/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,24)