methyl 4-chloranyl-3-[[4-(piperidin-1-ylmethyl)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[[4-(piperidin-1-ylmethyl)phenyl]carbonylamino]benzoate Openeye Name: methyl 4-chloro-3-[[4-(1-piperidylmethyl)benzoyl]amino]benzoate CAS Name: 4-chloro-3-[[oxo-[4-(1-piperidinylmethyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[4-(piperidin-1-ylmethyl)benzoyl]amino]benzoate Traditional Name: 4-chloro-3-[[4-(piperidinomethyl)benzoyl]amino]benzoic acid methyl ester Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)CN3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)CN3CCCCC3

InChI

InChI=1S/C21H23ClN2O3/c1-27-21(26)17-9-10-18(22)19(13-17)23-20(25)16-7-5-15(6-8-16)14-24-11-3-2-4-12-24/h5-10,13H,2-4,11-12,14H2,1H3,(H,23,25)