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

Systemtic Name: 4-nitro-N-(phenylmethyl)quinoline-2-sulfonamide Openeye Name: N-benzyl-4-nitro-quinoline-2-sulfonamide CAS Name: 4-nitro-N-(phenylmethyl)-2-quinolinesulfonamide IUPAC Name: N-benzyl-4-nitroquinoline-2-sulfonamide Traditional Name: N-benzyl-4-nitro-quinoline-2-sulfonamide Formula: C16H13N3O4S MolecularWeight: 343.35712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O4S/c20-19(21)15-10-16(18-14-9-5-4-8-13(14)15)24(22,23)17-11-12-6-2-1-3-7-12/h1-10,17H,11H2