N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C16H15N3O3 MolecularWeight: 297.3086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O3/c20-16(17-14-6-3-7-15(10-14)19(21)22)18-9-8-12-4-1-2-5-13(12)11-18/h1-7,10H,8-9,11H2,(H,17,20)