3-azanyl-4-nitro-N-(phenylmethyl)quinoline-2-sulfonamide

Systemtic Name: 3-azanyl-4-nitro-N-(phenylmethyl)quinoline-2-sulfonamide Openeye Name: 3-amino-N-benzyl-4-nitro-quinoline-2-sulfonamide CAS Name: 3-amino-4-nitro-N-(phenylmethyl)-2-quinolinesulfonamide IUPAC Name: 3-amino-N-benzyl-4-nitroquinoline-2-sulfonamide Traditional Name: 3-amino-N-benzyl-4-nitro-quinoline-2-sulfonamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=NC3=CC=CC=C3C(=C2N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=NC3=CC=CC=C3C(=C2N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S/c17-14-15(20(21)22)12-8-4-5-9-13(12)19-16(14)25(23,24)18-10-11-6-2-1-3-7-11/h1-9,18H,10,17H2