methyl 3-[4-[(4-cyano-2-methoxy-phenyl)carbamoyl-(2-hydroxyethyl)amino]phenyl]propanoate

Systemtic Name: methyl 3-[4-[(4-cyano-2-methoxy-phenyl)carbamoyl-(2-hydroxyethyl)amino]phenyl]propanoate Openeye Name: methyl 3-[4-[(4-cyano-2-methoxy-phenyl)carbamoyl-(2-hydroxyethyl)amino]phenyl]propanoate CAS Name: 3-[4-[[(4-cyano-2-methoxyanilino)-oxomethyl]-(2-hydroxyethyl)amino]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[(4-cyano-2-methoxyphenyl)carbamoyl-(2-hydroxyethyl)amino]phenyl]propanoate Traditional Name: 3-[4-[(4-cyano-2-methoxy-phenyl)carbamoyl-(2-hydroxyethyl)amino]phenyl]propionic acid methyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)NC(=O)N(CCO)C2=CC=C(C=C2)CCC(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)NC(=O)N(CCO)C2=CC=C(C=C2)CCC(=O)OC

InChI

InChI=1S/C21H23N3O5/c1-28-19-13-16(14-22)5-9-18(19)23-21(27)24(11-12-25)17-7-3-15(4-8-17)6-10-20(26)29-2/h3-5,7-9,13,25H,6,10-12H2,1-2H3,(H,23,27)