methyl (2S)-2-[[3-(dimethoxymethyl)phenyl]carbonylamino]-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: methyl (2S)-2-[[3-(dimethoxymethyl)phenyl]carbonylamino]-3-(1H-imidazol-5-yl)propanoate Openeye Name: methyl (2S)-2-[[3-(dimethoxymethyl)benzoyl]amino]-3-(1H-imidazol-5-yl)propanoate CAS Name: (2S)-2-[[[3-(dimethoxymethyl)phenyl]-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-(dimethoxymethyl)benzoyl]amino]-3-(1H-imidazol-5-yl)propanoate Traditional Name: (2S)-2-[[3-(dimethoxymethyl)benzoyl]amino]-3-(1H-imidazol-5-yl)propionic acid methyl ester Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC(=C1)C(=O)NC(CC2=CN=CN2)C(=O)OC)OC

Isomeric SMILES

COC(C1=CC=CC(=C1)C(=O)N[C@@H](CC2=CN=CN2)C(=O)OC)OC

InChI

InChI=1S/C17H21N3O5/c1-23-16(22)14(8-13-9-18-10-19-13)20-15(21)11-5-4-6-12(7-11)17(24-2)25-3/h4-7,9-10,14,17H,8H2,1-3H3,(H,18,19)(H,20,21)/t14-/m0/s1