ethyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enoyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)acryloyl]amino]-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C31H37NO6S MolecularWeight: 551.69358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OCC)C(=O)OCC)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)OCC)C(=O)OCC)OC

InChI

InChI=1S/C31H37NO6S/c1-5-8-9-10-19-38-26-17-11-22(20-27(26)35-4)12-18-28(33)32-30-29(31(34)37-7-3)25(21-39-30)23-13-15-24(16-14-23)36-6-2/h11-18,20-21H,5-10,19H2,1-4H3,(H,32,33)/b18-12+