3-[4-(3-chloranylpropoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-[4-(3-chloranylpropoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-[4-(3-chloropropoxy)phenyl]propanoic acid CAS Name: 3-[4-(3-chloropropoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-[4-(3-chloropropoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-[4-(3-chloropropoxy)phenyl]propionic acid Formula: C20H22ClNO5 MolecularWeight: 391.84538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)OCCCCl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)OCCCCl)C(=O)O

InChI

InChI=1S/C20H22ClNO5/c21-11-4-12-26-17-9-7-15(8-10-17)13-18(19(23)24)22-20(25)27-14-16-5-2-1-3-6-16/h1-3,5-10,18H,4,11-14H2,(H,22,25)(H,23,24)