methyl 4,5-dimethyl-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[(E)-3-(2-nitrophenyl)acryloyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O5S/c1-10-11(2)25-16(15(10)17(21)24-3)18-14(20)9-8-12-6-4-5-7-13(12)19(22)23/h4-9H,1-3H3,(H,18,20)/b9-8+