4-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-6-nitro-quinoline-3-carboxylic acid

Systemtic Name: 4-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-6-nitro-quinoline-3-carboxylic acid Openeye Name: 4-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-6-nitro-quinoline-3-carboxylic acid CAS Name: 4-[(4-methoxyphenyl)sulfonyl-(phenylmethyl)amino]-6-nitro-3-quinolinecarboxylic acid IUPAC Name: 4-[benzyl-(4-methoxyphenyl)sulfonylamino]-6-nitroquinoline-3-carboxylic acid Traditional Name: 4-[benzyl-(4-methoxyphenyl)sulfonyl-amino]-6-nitro-quinoline-3-carboxylic acid Formula: C24H19N3O7S MolecularWeight: 493.48856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=C4C=C(C=CC4=NC=C3C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=C4C=C(C=CC4=NC=C3C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C24H19N3O7S/c1-34-18-8-10-19(11-9-18)35(32,33)26(15-16-5-3-2-4-6-16)23-20-13-17(27(30)31)7-12-22(20)25-14-21(23)24(28)29/h2-14H,15H2,1H3,(H,28,29)