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

Systemtic Name: methyl 2-[[1-[(2-fluorophenyl)methyl]piperidin-3-yl]carbonylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[1-[(2-fluorophenyl)methyl]piperidine-3-carbonyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[[1-[(2-fluorophenyl)methyl]-3-piperidinyl]-oxomethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[1-[(2-fluorophenyl)methyl]piperidine-3-carbonyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[1-(2-fluorobenzyl)nipecotoyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C23H27FN2O5 MolecularWeight: 430.469283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCCN(C2)CC3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCCN(C2)CC3=CC=CC=C3F)OC

InChI

InChI=1S/C23H27FN2O5/c1-29-20-11-17(23(28)31-3)19(12-21(20)30-2)25-22(27)16-8-6-10-26(14-16)13-15-7-4-5-9-18(15)24/h4-5,7,9,11-12,16H,6,8,10,13-14H2,1-3H3,(H,25,27)