propan-2-yl 3-[(5-chloranylthiophen-2-yl)carbonylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[(5-chloranylthiophen-2-yl)carbonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[(5-chlorothiophene-2-carbonyl)amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[(5-chloro-2-thiophenyl)-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(5-chlorothiophene-2-carbonyl)amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[(5-chlorothiophene-2-carbonyl)amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C17H17ClN2O5S/c1-10(2)25-16(21)9-12(11-5-3-4-6-13(11)20(23)24)19-17(22)14-7-8-15(18)26-14/h3-8,10,12H,9H2,1-2H3,(H,19,22)