methyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethoxyphenyl)-2-[[(E)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enoyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)acryloyl]amino]-5-methyl-4-p-phenetyl-thiophene-3-carboxylic acid methyl ester Formula: C31H37NO6S MolecularWeight: 551.69358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)OCC)C(=O)OC)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)OCC)C(=O)OC)OC

InChI

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