2,3-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)indole-5-carboxylate

Systemtic Name: 2,3-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)indole-5-carboxylate Openeye Name: 2,3-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)indole-5-carboxylate CAS Name: 2,3-dimethyl-1-[2-(1-pyrrolidin-1-iumyl)ethyl]-5-indolecarboxylate IUPAC Name: 2,3-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)indole-5-carboxylate Traditional Name: 2,3-dimethyl-1-(2-pyrrolidin-1-ium-1-ylethyl)indole-5-carboxylate Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)[O-])CC[NH+]3CCCC3)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)[O-])CC[NH+]3CCCC3)C

InChI

InChI=1S/C17H22N2O2/c1-12-13(2)19(10-9-18-7-3-4-8-18)16-6-5-14(17(20)21)11-15(12)16/h5-6,11H,3-4,7-10H2,1-2H3,(H,20,21)