2-[4-[[(2-fluorophenyl)carbonylamino]methyl]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-[4-[[(2-fluorophenyl)carbonylamino]methyl]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-[[(2-fluorobenzoyl)amino]methyl]-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[[[(2-fluorophenyl)-oxomethyl]amino]methyl]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-[[(2-fluorobenzoyl)amino]methyl]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-[[(2-fluorobenzoyl)amino]methyl]piperidino]ethyl ester Formula: C23H27ClFN3O4 MolecularWeight: 463.929583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)CNC(=O)C3=CC=CC=C3F)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)CNC(=O)C3=CC=CC=C3F)Cl)N

InChI

InChI=1S/C23H27ClFN3O4/c1-31-21-13-20(26)18(24)12-17(21)23(30)32-11-10-28-8-6-15(7-9-28)14-27-22(29)16-4-2-3-5-19(16)25/h2-5,12-13,15H,6-11,14,26H2,1H3,(H,27,29)