ethyl 4-[[3-methyl-5-[(4-nitrophenyl)carbonylamino]-4-propanoyloxy-thiophen-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[3-methyl-5-[(4-nitrophenyl)carbonylamino]-4-propanoyloxy-thiophen-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-methyl-5-[(4-nitrobenzoyl)amino]-4-propanoyloxy-thiophene-2-carbonyl]amino]benzoate CAS Name: 4-[[[3-methyl-5-[[(4-nitrophenyl)-oxomethyl]amino]-4-(1-oxopropoxy)-2-thiophenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-methyl-5-[(4-nitrobenzoyl)amino]-4-propanoyloxythiophene-2-carbonyl]amino]benzoate Traditional Name: 4-[[3-methyl-5-[(4-nitrobenzoyl)amino]-4-propionyloxy-thiophene-2-carbonyl]amino]benzoic acid ethyl ester Formula: C25H23N3O8S MolecularWeight: 525.53042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)C(=O)OCC)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)OC1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)C(=O)OCC)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H23N3O8S/c1-4-19(29)36-20-14(3)21(23(31)26-17-10-6-16(7-11-17)25(32)35-5-2)37-24(20)27-22(30)15-8-12-18(13-9-15)28(33)34/h6-13H,4-5H2,1-3H3,(H,26,31)(H,27,30)