6,7-dimethoxy-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 6,7-dimethoxy-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6,7-dimethoxy-N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C18H19N3O5 MolecularWeight: 357.36056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H19N3O5/c1-25-16-8-12-6-7-20(11-13(12)9-17(16)26-2)18(22)19-14-4-3-5-15(10-14)21(23)24/h3-5,8-10H,6-7,11H2,1-2H3,(H,19,22)