methyl 4-[2-[(5-chloranyl-2-pyrrolidin-1-yl-phenyl)carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[(5-chloranyl-2-pyrrolidin-1-yl-phenyl)carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[(5-chloro-2-pyrrolidin-1-yl-benzoyl)amino]ethyl]benzoate CAS Name: 4-[2-[[[5-chloro-2-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(5-chloro-2-pyrrolidin-1-ylbenzoyl)amino]ethyl]benzoate Traditional Name: 4-[2-[(5-chloro-2-pyrrolidino-benzoyl)amino]ethyl]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)CCNC(=O)C2=C(C=CC(=C2)Cl)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)N3CCCC3

InChI

InChI=1S/C21H23ClN2O3/c1-27-21(26)16-6-4-15(5-7-16)10-11-23-20(25)18-14-17(22)8-9-19(18)24-12-2-3-13-24/h4-9,14H,2-3,10-13H2,1H3,(H,23,25)