1-[3-(dimethylazaniumyl)-2,2-dimethyl-propyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: 1-[3-(dimethylazaniumyl)-2,2-dimethyl-propyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: 1-[3-(dimethylammonio)-2,2-dimethyl-propyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[3-(dimethylammonio)-2,2-dimethylpropyl]-2,5-dimethyl-3-pyrrolecarboxylate IUPAC Name: 1-[3-(dimethylazaniumyl)-2,2-dimethylpropyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[3-(dimethylammonio)-2,2-dimethyl-propyl]-2,5-dimethyl-pyrrole-3-carboxylate Formula: C14H24N2O2 MolecularWeight: 252.35256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC(C)(C)C[NH+](C)C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CC(C)(C)C[NH+](C)C)C)C(=O)[O-]

InChI

InChI=1S/C14H24N2O2/c1-10-7-12(13(17)18)11(2)16(10)9-14(3,4)8-15(5)6/h7H,8-9H2,1-6H3,(H,17,18)