methyl 3-[[(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]amino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]amino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)prop-2-enoyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)acryloyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=CC(=O)NC(CC(=O)OC)C2=CC=CS2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)/C=C/C(=O)NC(CC(=O)OC)C2=CC=CS2)OC

InChI

InChI=1S/C20H22ClNO5S/c1-4-27-20-14(21)10-13(11-16(20)25-2)7-8-18(23)22-15(12-19(24)26-3)17-6-5-9-28-17/h5-11,15H,4,12H2,1-3H3,(H,22,23)/b8-7+