methyl 2-azanyl-3-[[4-[[(2-azanyl-3-methoxy-3-oxidanylidene-propyl)amino]oxymethyl]phenyl]carbonylamino]propanoate

Systemtic Name: methyl 2-azanyl-3-[[4-[[(2-azanyl-3-methoxy-3-oxidanylidene-propyl)amino]oxymethyl]phenyl]carbonylamino]propanoate Openeye Name: methyl 2-amino-3-[[4-[[(2-amino-3-methoxy-3-oxo-propyl)amino]oxymethyl]benzoyl]amino]propanoate CAS Name: 2-amino-3-[[[4-[[(2-amino-3-methoxy-3-oxopropyl)amino]oxymethyl]phenyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[[4-[[(2-amino-3-methoxy-3-oxopropyl)amino]oxymethyl]benzoyl]amino]propanoate Traditional Name: 2-amino-3-[[4-[[(2-amino-3-keto-3-methoxy-propyl)amino]oxymethyl]benzoyl]amino]propionic acid methyl ester Formula: C16H24N4O6 MolecularWeight: 368.38496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNC(=O)C1=CC=C(C=C1)CONCC(C(=O)OC)N)N

Isomeric SMILES

COC(=O)C(CNC(=O)C1=CC=C(C=C1)CONCC(C(=O)OC)N)N

InChI

InChI=1S/C16H24N4O6/c1-24-15(22)12(17)7-19-14(21)11-5-3-10(4-6-11)9-26-20-8-13(18)16(23)25-2/h3-6,12-13,20H,7-9,17-18H2,1-2H3,(H,19,21)