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

Systemtic Name: methyl 5-chloranyl-4-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-2-methoxy-benzoate Openeye Name: methyl 5-chloro-4-[3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoylamino]-2-methoxy-benzoate CAS Name: 5-chloro-4-[[3-(4-ethoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-chloro-4-[3-(4-ethoxy-3-methoxyphenyl)prop-2-enoylamino]-2-methoxybenzoate Traditional Name: 5-chloro-4-[[3-(4-ethoxy-3-methoxy-phenyl)acryloyl]amino]-2-methoxy-benzoic acid methyl ester Formula: C21H22ClNO6 MolecularWeight: 419.85548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClNO6/c1-5-29-17-8-6-13(10-19(17)27-3)7-9-20(24)23-16-12-18(26-2)14(11-15(16)22)21(25)28-4/h6-12H,5H2,1-4H3,(H,23,24)