2-[(3S)-1-[5-(cyclohexylcarbamoyl)-6-methoxy-pyridin-2-yl]piperidin-3-yl]ethanoic acid

Systemtic Name: 2-[(3S)-1-[5-(cyclohexylcarbamoyl)-6-methoxy-pyridin-2-yl]piperidin-3-yl]ethanoic acid Openeye Name: 2-[(3S)-1-[5-(cyclohexylcarbamoyl)-6-methoxy-2-pyridyl]-3-piperidyl]acetic acid CAS Name: 2-[(3S)-1-[5-[(cyclohexylamino)-oxomethyl]-6-methoxy-2-pyridinyl]-3-piperidinyl]acetic acid IUPAC Name: 2-[(3S)-1-[5-(cyclohexylcarbamoyl)-6-methoxypyridin-2-yl]piperidin-3-yl]acetic acid Traditional Name: 2-[(3S)-1-[5-(cyclohexylcarbamoyl)-6-methoxy-2-pyridyl]-3-piperidyl]acetic acid Formula: C20H29N3O4 MolecularWeight: 375.46196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=N1)N2CCCC(C2)CC(=O)O)C(=O)NC3CCCCC3

Isomeric SMILES

COC1=C(C=CC(=N1)N2CCC[C@H](C2)CC(=O)O)C(=O)NC3CCCCC3

InChI

InChI=1S/C20H29N3O4/c1-27-20-16(19(26)21-15-7-3-2-4-8-15)9-10-17(22-20)23-11-5-6-14(13-23)12-18(24)25/h9-10,14-15H,2-8,11-13H2,1H3,(H,21,26)(H,24,25)/t14-/m0/s1