methyl 3-[[(E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[(E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[(E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[(E)-3-(3-methoxy-4-propoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(3-methoxy-4-propoxyphenyl)prop-2-enoyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[(E)-3-(3-methoxy-4-propoxy-phenyl)acryloyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)NC(CC(=O)OC)C2=CC=CS2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)NC(CC(=O)OC)C2=CC=CS2)OC

InChI

InChI=1S/C21H25NO5S/c1-4-11-27-17-9-7-15(13-18(17)25-2)8-10-20(23)22-16(14-21(24)26-3)19-6-5-12-28-19/h5-10,12-13,16H,4,11,14H2,1-3H3,(H,22,23)/b10-8+