3-[4-(5-azanylpentoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-[4-(5-azanylpentoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 3-[4-(5-aminopentoxy)phenyl]-2-(benzyloxycarbonylamino)propanoic acid CAS Name: 3-[4-(5-aminopentoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-[4-(5-aminopentoxy)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-[4-(5-aminopentoxy)phenyl]-2-(benzyloxycarbonylamino)propionic acid Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O5/c23-13-5-2-6-14-28-19-11-9-17(10-12-19)15-20(21(25)26)24-22(27)29-16-18-7-3-1-4-8-18/h1,3-4,7-12,20H,2,5-6,13-16,23H2,(H,24,27)(H,25,26)