(2S)-3-(4-methoxyphenyl)-2-[(1-methylpiperidin-4-yl)carbonylamino]propanoic acid

Systemtic Name: (2S)-3-(4-methoxyphenyl)-2-[(1-methylpiperidin-4-yl)carbonylamino]propanoic acid Openeye Name: (2S)-3-(4-methoxyphenyl)-2-[(1-methylpiperidine-4-carbonyl)amino]propanoic acid CAS Name: (2S)-3-(4-methoxyphenyl)-2-[[(1-methyl-4-piperidinyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-3-(4-methoxyphenyl)-2-[(1-methylpiperidine-4-carbonyl)amino]propanoic acid Traditional Name: (2S)-3-(4-methoxyphenyl)-2-[(1-methylisonipecotoyl)amino]propionic acid Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C(=O)NC(CC2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CN1CCC(CC1)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C17H24N2O4/c1-19-9-7-13(8-10-19)16(20)18-15(17(21)22)11-12-3-5-14(23-2)6-4-12/h3-6,13,15H,7-11H2,1-2H3,(H,18,20)(H,21,22)/t15-/m0/s1