methyl 3-[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]ethyl-phenylmethoxycarbonyl-amino]propanoate

Systemtic Name: methyl 3-[2-[(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]ethyl-phenylmethoxycarbonyl-amino]propanoate Openeye Name: methyl 3-[2-[(2-amino-1-benzyl-2-oxo-ethyl)amino]ethyl-benzyloxycarbonyl-amino]propanoate CAS Name: 3-[2-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]ethyl-phenylmethoxycarbonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[(1-amino-1-oxo-3-phenylpropan-2-yl)amino]ethyl-phenylmethoxycarbonylamino]propanoate Traditional Name: 3-[2-[(2-amino-1-benzyl-2-keto-ethyl)amino]ethyl-carbobenzoxy-amino]propionic acid methyl ester Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(CCNC(CC1=CC=CC=C1)C(=O)N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCN(CCNC(CC1=CC=CC=C1)C(=O)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29N3O5/c1-30-21(27)12-14-26(23(29)31-17-19-10-6-3-7-11-19)15-13-25-20(22(24)28)16-18-8-4-2-5-9-18/h2-11,20,25H,12-17H2,1H3,(H2,24,28)