1-[nitro(phenylsulfonyl)methyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[nitro(phenylsulfonyl)methyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[benzenesulfonyl(nitro)methyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[benzenesulfonyl(nitro)methyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[benzenesulfonyl(nitro)methyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[besyl(nitro)methyl]-1,2,3,4-tetrahydroisoquinoline Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC=CC=C21)C([N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CNC(C2=CC=CC=C21)C([N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H16N2O4S/c19-18(20)16(23(21,22)13-7-2-1-3-8-13)15-14-9-5-4-6-12(14)10-11-17-15/h1-9,15-17H,10-11H2