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

Systemtic Name: methyl 3-[[(E)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]amino]-4-methyl-benzoate Openeye Name: methyl 3-[[(E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)prop-2-enoyl]amino]-4-methyl-benzoate CAS Name: 3-[[(E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)prop-2-enoyl]amino]-4-methylbenzoate Traditional Name: 3-[[(E)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)acryloyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)NC2=C(C=CC(=C2)C(=O)OC)C)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)NC2=C(C=CC(=C2)C(=O)OC)C)Cl)OC

InChI

InChI=1S/C21H22ClNO5/c1-5-28-18-11-14(10-16(22)20(18)26-3)7-9-19(24)23-17-12-15(21(25)27-4)8-6-13(17)2/h6-12H,5H2,1-4H3,(H,23,24)/b9-7+