ethyl 4-[[(E)-3-(4-butoxyphenyl)-2-cyano-prop-2-enoyl]amino]-5-chloranyl-2-methoxy-benzoate

Systemtic Name: ethyl 4-[[(E)-3-(4-butoxyphenyl)-2-cyano-prop-2-enoyl]amino]-5-chloranyl-2-methoxy-benzoate Openeye Name: ethyl 4-[[(E)-3-(4-butoxyphenyl)-2-cyano-prop-2-enoyl]amino]-5-chloro-2-methoxy-benzoate CAS Name: 4-[[(E)-3-(4-butoxyphenyl)-2-cyano-1-oxoprop-2-enyl]amino]-5-chloro-2-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(4-butoxyphenyl)-2-cyanoprop-2-enoyl]amino]-5-chloro-2-methoxybenzoate Traditional Name: 4-[[(E)-3-(4-butoxyphenyl)-2-cyano-acryloyl]amino]-5-chloro-2-methoxy-benzoic acid ethyl ester Formula: C24H25ClN2O5 MolecularWeight: 456.9187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=C(C(=C2)OC)C(=O)OCC)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=C(C(=C2)OC)C(=O)OCC)Cl

InChI

InChI=1S/C24H25ClN2O5/c1-4-6-11-32-18-9-7-16(8-10-18)12-17(15-26)23(28)27-21-14-22(30-3)19(13-20(21)25)24(29)31-5-2/h7-10,12-14H,4-6,11H2,1-3H3,(H,27,28)/b17-12+