6-(4-chlorophenyl)-3-(phenylmethoxycarbonylamino)hexanoic acid

Systemtic Name: 6-(4-chlorophenyl)-3-(phenylmethoxycarbonylamino)hexanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-6-(4-chlorophenyl)hexanoic acid CAS Name: 6-(4-chlorophenyl)-3-(phenylmethoxycarbonylamino)hexanoic acid IUPAC Name: 6-(4-chlorophenyl)-3-(phenylmethoxycarbonylamino)hexanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-6-(4-chlorophenyl)hexanoic acid Formula: C20H22ClNO4 MolecularWeight: 375.84598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCC2=CC=C(C=C2)Cl)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCC2=CC=C(C=C2)Cl)CC(=O)O

InChI

InChI=1S/C20H22ClNO4/c21-17-11-9-15(10-12-17)7-4-8-18(13-19(23)24)22-20(25)26-14-16-5-2-1-3-6-16/h1-3,5-6,9-12,18H,4,7-8,13-14H2,(H,22,25)(H,23,24)