dimethyl 3-methyl-5-[[(2S)-2-(4-nitrophenoxy)propanoyl]amino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[[(2S)-2-(4-nitrophenoxy)propanoyl]amino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[(2S)-2-(4-nitrophenoxy)propanoyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(2S)-2-(4-nitrophenoxy)-1-oxopropyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[[(2S)-2-(4-nitrophenoxy)propanoyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[(2S)-2-(4-nitrophenoxy)propanoyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H18N2O8S MolecularWeight: 422.40912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C(C)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)[C@H](C)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H18N2O8S/c1-9-13(17(22)26-3)16(29-14(9)18(23)27-4)19-15(21)10(2)28-12-7-5-11(6-8-12)20(24)25/h5-8,10H,1-4H3,(H,19,21)/t10-/m0/s1