methyl 2-[[(3S)-1-(4-fluorophenyl)carbonylpiperidin-3-yl]carbonylamino]-2-methyl-propanoate

Systemtic Name: methyl 2-[[(3S)-1-(4-fluorophenyl)carbonylpiperidin-3-yl]carbonylamino]-2-methyl-propanoate Openeye Name: methyl 2-[[(3S)-1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]-2-methyl-propanoate CAS Name: 2-[[[(3S)-1-[(4-fluorophenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]amino]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[[(3S)-1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]-2-methylpropanoate Traditional Name: 2-[[(3S)-1-(4-fluorobenzoyl)nipecotoyl]amino]-2-methyl-propionic acid methyl ester Formula: C18H23FN2O4 MolecularWeight: 350.384623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)C1CCCN(C1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)[C@H]1CCCN(C1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H23FN2O4/c1-18(2,17(24)25-3)20-15(22)13-5-4-10-21(11-13)16(23)12-6-8-14(19)9-7-12/h6-9,13H,4-5,10-11H2,1-3H3,(H,20,22)/t13-/m0/s1