2-[2-(2-nitrophenyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[2-(2-nitrophenyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[2-(2-nitrophenyl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-(2-nitrophenyl)-1-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[2-(2-nitrophenyl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[2-(2-nitrophenyl)acetyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)CC3=CC=CC=C3[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)CC3=CC=CC=C3[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C18H17N3O4/c19-18(23)16-9-12-5-1-2-7-14(12)11-20(16)17(22)10-13-6-3-4-8-15(13)21(24)25/h1-8,16H,9-11H2,(H2,19,23)