methyl 4-[3-[(4-chlorophenyl)-(cyanomethyl)amino]propoxy]benzoate

Systemtic Name: methyl 4-[3-[(4-chlorophenyl)-(cyanomethyl)amino]propoxy]benzoate Openeye Name: methyl 4-[3-[4-chloro-N-(cyanomethyl)anilino]propoxy]benzoate CAS Name: 4-[3-[4-chloro-N-(cyanomethyl)anilino]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[4-chloro-N-(cyanomethyl)anilino]propoxy]benzoate Traditional Name: 4-[3-[4-chloro-N-(cyanomethyl)anilino]propoxy]benzoic acid methyl ester Formula: C19H19ClN2O3 MolecularWeight: 358.81876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCCCN(CC#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCCCN(CC#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H19ClN2O3/c1-24-19(23)15-3-9-18(10-4-15)25-14-2-12-22(13-11-21)17-7-5-16(20)6-8-17/h3-10H,2,12-14H2,1H3