methyl 2-[(1S)-1-azanyl-2-methyl-propyl]-5-methyl-1-(phenylmethyl)imidazole-4-carboxylate

Systemtic Name: methyl 2-[(1S)-1-azanyl-2-methyl-propyl]-5-methyl-1-(phenylmethyl)imidazole-4-carboxylate Openeye Name: methyl 2-[(1S)-1-amino-2-methyl-propyl]-1-benzyl-5-methyl-imidazole-4-carboxylate CAS Name: 2-[(1S)-1-amino-2-methylpropyl]-5-methyl-1-(phenylmethyl)-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1S)-1-amino-2-methylpropyl]-1-benzyl-5-methylimidazole-4-carboxylate Traditional Name: 2-[(1S)-1-amino-2-methyl-propyl]-1-benzyl-5-methyl-imidazole-4-carboxylic acid methyl ester Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1CC2=CC=CC=C2)C(C(C)C)N)C(=O)OC

Isomeric SMILES

CC1=C(N=C(N1CC2=CC=CC=C2)[C@H](C(C)C)N)C(=O)OC

InChI

InChI=1S/C17H23N3O2/c1-11(2)14(18)16-19-15(17(21)22-4)12(3)20(16)10-13-8-6-5-7-9-13/h5-9,11,14H,10,18H2,1-4H3/t14-/m0/s1