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

Systemtic Name: propan-2-yl 2-[(2,4-dinitrophenyl)carbonylamino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: isopropyl 2-[(2,4-dinitrobenzoyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(2,4-dinitrophenyl)-oxomethyl]amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(2,4-dinitrobenzoyl)amino]-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(2,4-dinitrobenzoyl)amino]-4-p-phenetyl-thiophene-3-carboxylic acid isopropyl ester Formula: C23H21N3O8S MolecularWeight: 499.49314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=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/C23H21N3O8S/c1-4-33-16-8-5-14(6-9-16)18-12-35-22(20(18)23(28)34-13(2)3)24-21(27)17-10-7-15(25(29)30)11-19(17)26(31)32/h5-13H,4H2,1-3H3,(H,24,27)