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

Systemtic Name: methyl 5-chloranyl-4-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]-2-methoxy-benzoate Openeye Name: methyl 5-chloro-4-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoyl]amino]-2-methoxy-benzoate CAS Name: 5-chloro-4-[[(E)-3-(4-hexoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-chloro-4-[[(E)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enoyl]amino]-2-methoxybenzoate Traditional Name: 5-chloro-4-[[(E)-3-(4-hexoxy-3-methoxy-phenyl)acryloyl]amino]-2-methoxy-benzoic acid methyl ester Formula: C25H30ClNO6 MolecularWeight: 475.9618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=C(C(=C2)OC)C(=O)OC)Cl)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(C=C(C(=C2)OC)C(=O)OC)Cl)OC

InChI

InChI=1S/C25H30ClNO6/c1-5-6-7-8-13-33-21-11-9-17(14-23(21)31-3)10-12-24(28)27-20-16-22(30-2)18(15-19(20)26)25(29)32-4/h9-12,14-16H,5-8,13H2,1-4H3,(H,27,28)/b12-10+