5,5,6-trimethyl-2-(phenylmethoxycarbonylamino)heptanoic acid

Systemtic Name: 5,5,6-trimethyl-2-(phenylmethoxycarbonylamino)heptanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-5,5,6-trimethyl-heptanoic acid CAS Name: 5,5,6-trimethyl-2-(phenylmethoxycarbonylamino)heptanoic acid IUPAC Name: 5,5,6-trimethyl-2-(phenylmethoxycarbonylamino)heptanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-5,5,6-trimethyl-enanthic acid Formula: C18H27NO4 MolecularWeight: 321.41128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C)(C)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H27NO4/c1-13(2)18(3,4)11-10-15(16(20)21)19-17(22)23-12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,19,22)(H,20,21)