(2S)-3-(1H-imidazol-5-yl)-2-pyrrol-1-yl-propanoate

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-pyrrol-1-yl-propanoate Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-pyrrol-1-yl-propanoate CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-(1-pyrrolyl)propanoate IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-pyrrol-1-ylpropanoate Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-pyrrol-1-yl-propionate Formula: C10H10N3O2- MolecularWeight: 204.2053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C(CC2=CN=CN2)C(=O)[O-]

Isomeric SMILES

C1=CN(C=C1)[C@@H](CC2=CN=CN2)C(=O)[O-]

InChI

InChI=1S/C10H11N3O2/c14-10(15)9(13-3-1-2-4-13)5-8-6-11-7-12-8/h1-4,6-7,9H,5H2,(H,11,12)(H,14,15)/p-1/t9-/m0/s1