4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(phenylmethyl)piperidine-4-carboxylic acid

Systemtic Name: 4-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(phenylmethyl)piperidine-4-carboxylic acid Openeye Name: 1-benzyl-4-(tert-butoxycarbonylamino)piperidine-4-carboxylic acid CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-(phenylmethyl)-4-piperidinecarboxylic acid IUPAC Name: 1-benzyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidine-4-carboxylic acid Traditional Name: 1-benzyl-4-(tert-butoxycarbonylamino)isonipecotic acid Formula: C18H26N2O4 MolecularWeight: 334.41004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1(CCN(CC1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1(CCN(CC1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H26N2O4/c1-17(2,3)24-16(23)19-18(15(21)22)9-11-20(12-10-18)13-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3,(H,19,23)(H,21,22)