2-[(4-cyanophenyl)amino]-2-[3-(diethylaminomethyl)-5-ethoxy-phenyl]ethanoate

Systemtic Name: 2-[(4-cyanophenyl)amino]-2-[3-(diethylaminomethyl)-5-ethoxy-phenyl]ethanoate Openeye Name: 2-(4-cyanoanilino)-2-[3-(diethylaminomethyl)-5-ethoxy-phenyl]acetate CAS Name: 2-(4-cyanoanilino)-2-[3-(diethylaminomethyl)-5-ethoxyphenyl]acetate IUPAC Name: 2-(4-cyanoanilino)-2-[3-(diethylaminomethyl)-5-ethoxyphenyl]acetate Traditional Name: 2-(4-cyanoanilino)-2-[3-(diethylaminomethyl)-5-ethoxy-phenyl]acetate Formula: C22H26N3O3- MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC(=C1)OCC)C(C(=O)[O-])NC2=CC=C(C=C2)C#N

Isomeric SMILES

CCN(CC)CC1=CC(=CC(=C1)OCC)C(C(=O)[O-])NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H27N3O3/c1-4-25(5-2)15-17-11-18(13-20(12-17)28-6-3)21(22(26)27)24-19-9-7-16(14-23)8-10-19/h7-13,21,24H,4-6,15H2,1-3H3,(H,26,27)/p-1