N-(2-chloranyl-4-nitro-phenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Formula: C23H22ClN3O5S MolecularWeight: 487.95588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)CC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C4=CC=CS4)OC

InChI

InChI=1S/C23H22ClN3O5S/c1-31-19-10-14-7-8-26(23(21-4-3-9-33-21)16(14)12-20(19)32-2)13-22(28)25-18-6-5-15(27(29)30)11-17(18)24/h3-6,9-12,23H,7-8,13H2,1-2H3,(H,25,28)/t23-/m0/s1