methyl 3-methyl-5-[(E)-3-(2-nitrophenyl)prop-2-enoyl]thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-methyl-5-[(E)-3-(2-nitrophenyl)prop-2-enoyl]thieno[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-methyl-5-[(E)-3-(2-nitrophenyl)prop-2-enoyl]thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-methyl-5-[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]-2-thieno[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-[(E)-3-(2-nitrophenyl)prop-2-enoyl]thieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-methyl-5-[(E)-3-(2-nitrophenyl)acryloyl]thieno[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C19H14N2O5S MolecularWeight: 382.38986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=C(C=C12)C(=O)C=CC3=CC=CC=C3[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC=C(C=C12)C(=O)/C=C/C3=CC=CC=C3[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H14N2O5S/c1-11-14-9-13(10-20-18(14)27-17(11)19(23)26-2)16(22)8-7-12-5-3-4-6-15(12)21(24)25/h3-10H,1-2H3/b8-7+