1-[6-(2-methylpropyl)-1,3-benzoxazol-2-yl]piperidine-2-carboxylic acid

Systemtic Name: 1-[6-(2-methylpropyl)-1,3-benzoxazol-2-yl]piperidine-2-carboxylic acid Openeye Name: 1-(6-isobutyl-1,3-benzoxazol-2-yl)piperidine-2-carboxylic acid CAS Name: 1-[6-(2-methylpropyl)-1,3-benzoxazol-2-yl]-2-piperidinecarboxylic acid IUPAC Name: 1-[6-(2-methylpropyl)-1,3-benzoxazol-2-yl]piperidine-2-carboxylic acid Traditional Name: 1-(6-isobutyl-1,3-benzoxazol-2-yl)pipecolinic acid Formula: C17H22N2O3 MolecularWeight: 302.36818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC2=C(C=C1)N=C(O2)N3CCCCC3C(=O)O

Isomeric SMILES

CC(C)CC1=CC2=C(C=C1)N=C(O2)N3CCCCC3C(=O)O

InChI

InChI=1S/C17H22N2O3/c1-11(2)9-12-6-7-13-15(10-12)22-17(18-13)19-8-4-3-5-14(19)16(20)21/h6-7,10-11,14H,3-5,8-9H2,1-2H3,(H,20,21)