2-methylsulfonyl-5-nitro-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-methylsulfonyl-5-nitro-3,4-dihydro-1H-isoquinoline Openeye Name: 2-methylsulfonyl-5-nitro-3,4-dihydro-1H-isoquinoline CAS Name: 2-methylsulfonyl-5-nitro-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-methylsulfonyl-5-nitro-3,4-dihydro-1H-isoquinoline Traditional Name: 2-mesyl-5-nitro-3,4-dihydro-1H-isoquinoline Formula: C10H12N2O4S MolecularWeight: 256.27828

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C(C1)C=CC=C2[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC2=C(C1)C=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C10H12N2O4S/c1-17(15,16)11-6-5-9-8(7-11)3-2-4-10(9)12(13)14/h2-4H,5-7H2,1H3