1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-nitrophenoxy)propan-2-ol

Systemtic Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-nitrophenoxy)propan-2-ol Openeye Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-(3-nitrophenoxy)propan-2-ol CAS Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-nitrophenoxy)-2-propanol IUPAC Name: 1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(3-nitrophenoxy)propan-2-ol Traditional Name: 1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-(3-nitrophenoxy)propan-2-ol Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(COC3=CC=CC(=C3)[N+](=O)[O-])O)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC(COC3=CC=CC(=C3)[N+](=O)[O-])O)C4=CC=CS4)OC

InChI

InChI=1S/C24H26N2O6S/c1-30-21-11-16-8-9-25(24(23-7-4-10-33-23)20(16)13-22(21)31-2)14-18(27)15-32-19-6-3-5-17(12-19)26(28)29/h3-7,10-13,18,24,27H,8-9,14-15H2,1-2H3