methyl 5-[(2S)-2-(3-ethenylbenzimidazol-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[(2S)-2-(3-ethenylbenzimidazol-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[(2S)-2-(3-vinylbenzimidazol-1-ium-1-yl)propanoyl]-1H-pyrrole-3-carboxylate CAS Name: 5-[(2S)-2-(3-ethenyl-1-benzimidazol-1-iumyl)-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(2S)-2-(3-ethenylbenzimidazol-1-ium-1-yl)propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2S)-2-(3-vinylbenzimidazol-1-ium-1-yl)propanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)[N+]2=CN(C3=CC=CC=C32)C=C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)[N+]2=CN(C3=CC=CC=C32)C=C

InChI

InChI=1S/C20H21N3O3/c1-6-22-11-23(16-10-8-7-9-15(16)22)14(4)19(24)18-12(2)17(13(3)21-18)20(25)26-5/h6-11,14H,1H2,2-5H3/p+1/t14-/m0/s1