methyl 2-[[1-(4-fluorophenyl)carbonylpiperidin-3-yl]carbonylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[[1-(4-fluorophenyl)carbonylpiperidin-3-yl]carbonylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[[1-[(4-fluorophenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[1-(4-fluorobenzoyl)nipecotoyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C23H25FN2O6 MolecularWeight: 444.452803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C23H25FN2O6/c1-30-19-11-17(23(29)32-3)18(12-20(19)31-2)25-21(27)15-5-4-10-26(13-15)22(28)14-6-8-16(24)9-7-14/h6-9,11-12,15H,4-5,10,13H2,1-3H3,(H,25,27)