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

Systemtic Name: 6,7-dimethoxy-N-(2-nitrophenyl)-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 6,7-dimethoxy-N-(2-nitrophenyl)-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-(2-nitrophenyl)-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-(2-nitrophenyl)-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 6,7-dimethoxy-N-(2-nitrophenyl)-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC=C3[N+](=O)[O-])C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=CC=C3[N+](=O)[O-])C4=CC=CS4)OC

InChI

InChI=1S/C22H21N3O5S/c1-29-18-12-14-9-10-24(22(26)23-16-6-3-4-7-17(16)25(27)28)21(20-8-5-11-31-20)15(14)13-19(18)30-2/h3-8,11-13,21H,9-10H2,1-2H3,(H,23,26)