methyl 4-[[3-[(3-fluorophenyl)amino]piperidin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[3-[(3-fluorophenyl)amino]piperidin-1-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[3-(3-fluoroanilino)piperidine-1-carbonyl]amino]benzoate CAS Name: 4-[[[3-(3-fluoroanilino)-1-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3-fluoroanilino)piperidine-1-carbonyl]amino]benzoate Traditional Name: 4-[[3-(3-fluoroanilino)piperidine-1-carbonyl]amino]benzoic acid methyl ester Formula: C20H22FN3O3 MolecularWeight: 371.405383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCCC(C2)NC3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)N2CCCC(C2)NC3=CC(=CC=C3)F

InChI

InChI=1S/C20H22FN3O3/c1-27-19(25)14-7-9-16(10-8-14)23-20(26)24-11-3-6-18(13-24)22-17-5-2-4-15(21)12-17/h2,4-5,7-10,12,18,22H,3,6,11,13H2,1H3,(H,23,26)