3-nitro-4-(phenylmethyl)sulfonyl-quinoline

Systemtic Name: 3-nitro-4-(phenylmethyl)sulfonyl-quinoline Openeye Name: 4-benzylsulfonyl-3-nitro-quinoline CAS Name: 3-nitro-4-(phenylmethyl)sulfonylquinoline IUPAC Name: 4-benzylsulfonyl-3-nitroquinoline Traditional Name: 4-benzylsulfonyl-3-nitro-quinoline Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C=NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C=NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O4S/c19-18(20)15-10-17-14-9-5-4-8-13(14)16(15)23(21,22)11-12-6-2-1-3-7-12/h1-10H,11H2