2-(3-nitrophenyl)sulfonyl-1-thiophen-3-yl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(3-nitrophenyl)sulfonyl-1-thiophen-3-yl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3-nitrophenyl)sulfonyl-1-(3-thienyl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-(3-nitrophenyl)sulfonyl-1-(3-thiophenyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3-nitrophenyl)sulfonyl-1-thiophen-3-yl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3-nitrophenyl)sulfonyl-1-(3-thienyl)-3,4-dihydro-1H-isoquinoline Formula: C19H16N2O4S2 MolecularWeight: 400.47134

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)C3=CSC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)C3=CSC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O4S2/c22-21(23)16-5-3-6-17(12-16)27(24,25)20-10-8-14-4-1-2-7-18(14)19(20)15-9-11-26-13-15/h1-7,9,11-13,19H,8,10H2