N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-methyl-5-nitro-pyridine-3-carboxamide

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-methyl-5-nitro-pyridine-3-carboxamide Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-methyl-5-nitro-pyridine-3-carboxamide CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-methyl-5-nitro-3-pyridinecarboxamide IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-methyl-5-nitropyridine-3-carboxamide Traditional Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-methyl-5-nitro-nicotinamide Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C(=O)NCCCN2CCC3=CC=CC=C3C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C=C1C(=O)NCCCN2CCC3=CC=CC=C3C2)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O3/c1-14-18(11-17(12-21-14)23(25)26)19(24)20-8-4-9-22-10-7-15-5-2-3-6-16(15)13-22/h2-3,5-6,11-12H,4,7-10,13H2,1H3,(H,20,24)