[5-[(Z)-2-cyano-1-(3-ethoxy-4-methoxy-phenyl)ethenyl]-2-methoxy-phenyl] 2-azanylethanoate hydrochloride

Systemtic Name: [5-[(Z)-2-cyano-1-(3-ethoxy-4-methoxy-phenyl)ethenyl]-2-methoxy-phenyl] 2-azanylethanoate hydrochloride Openeye Name: [5-[(Z)-2-cyano-1-(3-ethoxy-4-methoxy-phenyl)vinyl]-2-methoxy-phenyl] 2-aminoacetate hydrochloride CAS Name: 2-aminoacetic acid [5-[(Z)-2-cyano-1-(3-ethoxy-4-methoxyphenyl)ethenyl]-2-methoxyphenyl] ester hydrochloride IUPAC Name: [5-[(Z)-2-cyano-1-(3-ethoxy-4-methoxyphenyl)ethenyl]-2-methoxyphenyl] 2-aminoacetate hydrochloride Traditional Name: 2-aminoacetic acid [5-[(Z)-2-cyano-1-(3-ethoxy-4-methoxy-phenyl)vinyl]-2-methoxy-phenyl] ester hydrochloride Formula: C21H23ClN2O5 MolecularWeight: 418.87072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=CC#N)C2=CC(=C(C=C2)OC)OC(=O)CN)OC.Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C(=C/C#N)/C2=CC(=C(C=C2)OC)OC(=O)CN)OC.Cl

InChI

InChI=1S/C21H22N2O5.ClH/c1-4-27-19-11-14(5-7-17(19)25-2)16(9-10-22)15-6-8-18(26-3)20(12-15)28-21(24)13-23;/h5-9,11-12H,4,13,23H2,1-3H3;1H/b16-9-;