propan-2-yl 2-[(2,4-dinitrophenyl)carbonylamino]-4-(3-methylphenyl)thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[(2,4-dinitrophenyl)carbonylamino]-4-(3-methylphenyl)thiophene-3-carboxylate Openeye Name: isopropyl 2-[(2,4-dinitrobenzoyl)amino]-4-(m-tolyl)thiophene-3-carboxylate CAS Name: 2-[[(2,4-dinitrophenyl)-oxomethyl]amino]-4-(3-methylphenyl)-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(2,4-dinitrobenzoyl)amino]-4-(3-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(2,4-dinitrobenzoyl)amino]-4-(m-tolyl)thiophene-3-carboxylic acid isopropyl ester Formula: C22H19N3O7S MolecularWeight: 469.46716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O7S/c1-12(2)32-22(27)19-17(14-6-4-5-13(3)9-14)11-33-21(19)23-20(26)16-8-7-15(24(28)29)10-18(16)25(30)31/h4-12H,1-3H3,(H,23,26)