methyl 3-[2-[(E)-dimethylaminomethylideneamino]imidazol-1-yl]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-[2-[(E)-dimethylaminomethylideneamino]imidazol-1-yl]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-[2-[(E)-dimethylaminomethyleneamino]imidazol-1-yl]propanoate CAS Name: 3-[2-[(E)-dimethylaminomethylideneamino]-1-imidazolyl]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-[2-[(E)-dimethylaminomethylideneamino]imidazol-1-yl]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-[2-[(E)-dimethylaminomethyleneamino]imidazol-1-yl]propionic acid methyl ester Formula: C18H23N5O4 MolecularWeight: 373.40632

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NC1=NC=CN1CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CN(C)/C=N/C1=NC=CN1CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H23N5O4/c1-22(2)13-20-17-19-9-10-23(17)11-15(16(24)26-3)21-18(25)27-12-14-7-5-4-6-8-14/h4-10,13,15H,11-12H2,1-3H3,(H,21,25)/b20-13+