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

Systemtic Name: 2-[4-[(2-fluorophenyl)carbonylamino]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-[(2-fluorobenzoyl)amino]-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]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-[(2-fluorobenzoyl)amino]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]piperidino]ethyl ester Formula: C22H25ClFN3O4 MolecularWeight: 449.903003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClFN3O4/c1-30-20-13-19(25)17(23)12-16(20)22(29)31-11-10-27-8-6-14(7-9-27)26-21(28)15-4-2-3-5-18(15)24/h2-5,12-14H,6-11,25H2,1H3,(H,26,28)