(2S)-2-acetamido-3-phenyl-propanoic acid; 2-(1-methoxypiperidin-2-yl)pyridine

Systemtic Name: (2S)-2-acetamido-3-phenyl-propanoic acid; 2-(1-methoxypiperidin-2-yl)pyridine Openeye Name: (2S)-2-acetamido-3-phenyl-propanoic acid; 2-(1-methoxy-2-piperidyl)pyridine CAS Name: (2S)-2-acetamido-3-phenylpropanoic acid; 2-(1-methoxy-2-piperidinyl)pyridine IUPAC Name: (2S)-2-acetamido-3-phenylpropanoic acid; 2-(1-methoxypiperidin-2-yl)pyridine Traditional Name: (2S)-2-acetamido-3-phenyl-propionic acid; 2-(1-methoxy-2-piperidyl)pyridine Formula: C22H29N3O4 MolecularWeight: 399.48336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=CC=C1)C(=O)O.CON1CCCCC1C2=CC=CC=N2

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O.CON1CCCCC1C2=CC=CC=N2

InChI

InChI=1S/C11H16N2O.C11H13NO3/c1-14-13-9-5-3-7-11(13)10-6-2-4-8-12-10;1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9/h2,4,6,8,11H,3,5,7,9H2,1H3;2-6,10H,7H2,1H3,(H,12,13)(H,14,15)/t;10-/m.0/s1