2-(4-methoxy-3-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(4-methoxy-3-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(4-methoxy-3-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-(4-methoxy-3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(4-methoxy-3-nitrophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(4-methoxy-3-nitro-phenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S/c1-23-16-7-6-14(10-15(16)18(19)20)24(21,22)17-9-8-12-4-2-3-5-13(12)11-17/h2-7,10H,8-9,11H2,1H3