3-(4-methoxyphenyl)-2-[6-(phenylmethoxycarbonylamino)hexanoylamino]propanoic acid

Systemtic Name: 3-(4-methoxyphenyl)-2-[6-(phenylmethoxycarbonylamino)hexanoylamino]propanoic acid Openeye Name: 2-[6-(benzyloxycarbonylamino)hexanoylamino]-3-(4-methoxyphenyl)propanoic acid CAS Name: 3-(4-methoxyphenyl)-2-[[1-oxo-6-(phenylmethoxycarbonylamino)hexyl]amino]propanoic acid IUPAC Name: 3-(4-methoxyphenyl)-2-[6-(phenylmethoxycarbonylamino)hexanoylamino]propanoic acid Traditional Name: 2-[6-(benzyloxycarbonylamino)hexanoylamino]-3-(4-methoxyphenyl)propionic acid Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCCCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)O)NC(=O)CCCCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O6/c1-31-20-13-11-18(12-14-20)16-21(23(28)29)26-22(27)10-6-3-7-15-25-24(30)32-17-19-8-4-2-5-9-19/h2,4-5,8-9,11-14,21H,3,6-7,10,15-17H2,1H3,(H,25,30)(H,26,27)(H,28,29)