3-(1-methylimidazol-4-yl)-2-[[methyl-(phenylmethyl)carbamoyl]amino]propanoic acid

Systemtic Name: 3-(1-methylimidazol-4-yl)-2-[[methyl-(phenylmethyl)carbamoyl]amino]propanoic acid Openeye Name: 2-[[benzyl(methyl)carbamoyl]amino]-3-(1-methylimidazol-4-yl)propanoic acid CAS Name: 3-(1-methyl-4-imidazolyl)-2-[[[methyl-(phenylmethyl)amino]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[benzyl(methyl)carbamoyl]amino]-3-(1-methylimidazol-4-yl)propanoic acid Traditional Name: 2-[[benzyl(methyl)carbamoyl]amino]-3-(1-methylimidazol-4-yl)propionic acid Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)CC(C(=O)O)NC(=O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CN1C=C(N=C1)CC(C(=O)O)NC(=O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N4O3/c1-19-10-13(17-11-19)8-14(15(21)22)18-16(23)20(2)9-12-6-4-3-5-7-12/h3-7,10-11,14H,8-9H2,1-2H3,(H,18,23)(H,21,22)