2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid Openeye Name: 2-[(2-chloro-5-nitro-benzoyl)amino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid CAS Name: 2-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-4-methyl-5-phenyl-3-thiophenecarboxylic acid IUPAC Name: 2-[(2-chloro-5-nitrobenzoyl)amino]-4-methyl-5-phenylthiophene-3-carboxylic acid Traditional Name: 2-[(2-chloro-5-nitro-benzoyl)amino]-4-methyl-5-phenyl-3-thenoic acid Formula: C19H13ClN2O5S MolecularWeight: 416.83492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H13ClN2O5S/c1-10-15(19(24)25)18(28-16(10)11-5-3-2-4-6-11)21-17(23)13-9-12(22(26)27)7-8-14(13)20/h2-9H,1H3,(H,21,23)(H,24,25)