methyl 2-[4-[2-azanyl-3-(4-chlorophenyl)propanoyl]piperazin-1-yl]benzoate

Systemtic Name: methyl 2-[4-[2-azanyl-3-(4-chlorophenyl)propanoyl]piperazin-1-yl]benzoate Openeye Name: methyl 2-[4-[2-amino-3-(4-chlorophenyl)propanoyl]piperazin-1-yl]benzoate CAS Name: 2-[4-[2-amino-3-(4-chlorophenyl)-1-oxopropyl]-1-piperazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[2-amino-3-(4-chlorophenyl)propanoyl]piperazin-1-yl]benzoate Traditional Name: 2-[4-[2-amino-3-(4-chlorophenyl)propanoyl]piperazino]benzoic acid methyl ester Formula: C21H24ClN3O3 MolecularWeight: 401.88656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2CCN(CC2)C(=O)C(CC3=CC=C(C=C3)Cl)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2CCN(CC2)C(=O)C(CC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C21H24ClN3O3/c1-28-21(27)17-4-2-3-5-19(17)24-10-12-25(13-11-24)20(26)18(23)14-15-6-8-16(22)9-7-15/h2-9,18H,10-14,23H2,1H3