methyl 2-(phenylmethoxycarbonylamino)-3-[3-(phenylmethyl)imidazol-4-yl]propanoate

Systemtic Name: methyl 2-(phenylmethoxycarbonylamino)-3-[3-(phenylmethyl)imidazol-4-yl]propanoate Openeye Name: methyl 3-(3-benzylimidazol-4-yl)-2-(benzyloxycarbonylamino)propanoate CAS Name: 2-(phenylmethoxycarbonylamino)-3-[3-(phenylmethyl)-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(3-benzylimidazol-4-yl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(3-benzylimidazol-4-yl)-2-(benzyloxycarbonylamino)propionic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN=CN1CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CC1=CN=CN1CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O4/c1-28-21(26)20(24-22(27)29-15-18-10-6-3-7-11-18)12-19-13-23-16-25(19)14-17-8-4-2-5-9-17/h2-11,13,16,20H,12,14-15H2,1H3,(H,24,27)