3-[4-[(E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]phenoxy]propanoic acid

Systemtic Name: 3-[4-[(E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]phenoxy]propanoic acid Openeye Name: 3-[4-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxo-prop-1-enyl]phenoxy]propanoic acid CAS Name: 3-[4-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]phenoxy]propanoic acid IUPAC Name: 3-[4-[(E)-2-cyano-3-(4-methoxyanilino)-3-oxoprop-1-enyl]phenoxy]propanoic acid Traditional Name: 3-[4-[(E)-2-cyano-3-keto-3-(p-anisidino)prop-1-enyl]phenoxy]propionic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(C=C2)OCCC(=O)O)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(C=C2)OCCC(=O)O)/C#N

InChI

InChI=1S/C20H18N2O5/c1-26-17-8-4-16(5-9-17)22-20(25)15(13-21)12-14-2-6-18(7-3-14)27-11-10-19(23)24/h2-9,12H,10-11H2,1H3,(H,22,25)(H,23,24)/b15-12+