6,7-dimethoxy-2-[(2-nitrophenyl)methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[(2-nitrophenyl)methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[(2-nitrophenyl)methyl]-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[(2-nitrophenyl)methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[(2-nitrophenyl)methyl]-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-(2-nitrobenzyl)-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC3=CC=CC=C3[N+](=O)[O-])C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC3=CC=CC=C3[N+](=O)[O-])C4=CC=CS4)OC

InChI

InChI=1S/C22H22N2O4S/c1-27-19-12-15-9-10-23(14-16-6-3-4-7-18(16)24(25)26)22(21-8-5-11-29-21)17(15)13-20(19)28-2/h3-8,11-13,22H,9-10,14H2,1-2H3