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

Systemtic Name: methyl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[(E)-3-(3-nitrophenyl)acryloyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C16H14N2O5S MolecularWeight: 346.35776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H14N2O5S/c1-10-8-14(24-15(10)16(20)23-2)17-13(19)7-6-11-4-3-5-12(9-11)18(21)22/h3-9H,1-2H3,(H,17,19)/b7-6+