(2S)-3-(2-ethylbenzimidazol-1-yl)-2-methyl-propanoate

Systemtic Name: (2S)-3-(2-ethylbenzimidazol-1-yl)-2-methyl-propanoate Openeye Name: (2S)-3-(2-ethylbenzimidazol-1-yl)-2-methyl-propanoate CAS Name: (2S)-3-(2-ethyl-1-benzimidazolyl)-2-methylpropanoate IUPAC Name: (2S)-3-(2-ethylbenzimidazol-1-yl)-2-methylpropanoate Traditional Name: (2S)-3-(2-ethylbenzimidazol-1-yl)-2-methyl-propionate Formula: C13H15N2O2- MolecularWeight: 231.2704

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2N1CC(C)C(=O)[O-]

Isomeric SMILES

CCC1=NC2=CC=CC=C2N1C[C@H](C)C(=O)[O-]

InChI

InChI=1S/C13H16N2O2/c1-3-12-14-10-6-4-5-7-11(10)15(12)8-9(2)13(16)17/h4-7,9H,3,8H2,1-2H3,(H,16,17)/p-1/t9-/m0/s1