N-[3-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]ethanamide; ethanoic acid

Systemtic Name: N-[3-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]ethanamide; ethanoic acid Openeye Name: acetic acid; N-[3-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]acetamide CAS Name: acetic acid; N-[3-[2-cyanoethyl(ethyl)amino]-4-methoxyphenyl]acetamide IUPAC Name: acetic acid; N-[3-[2-cyanoethyl(ethyl)amino]-4-methoxyphenyl]acetamide Traditional Name: acetic acid; N-[3-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]acetamide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC#N)C1=C(C=CC(=C1)NC(=O)C)OC.CC(=O)O

Isomeric SMILES

CCN(CCC#N)C1=C(C=CC(=C1)NC(=O)C)OC.CC(=O)O

InChI

InChI=1S/C14H19N3O2.C2H4O2/c1-4-17(9-5-8-15)13-10-12(16-11(2)18)6-7-14(13)19-3;1-2(3)4/h6-7,10H,4-5,9H2,1-3H3,(H,16,18);1H3,(H,3,4)