2-pyrrolidin-1-ium-1-ylethyl 1H-indol-1-ium-2-carboxylate dichloride

Systemtic Name: 2-pyrrolidin-1-ium-1-ylethyl 1H-indol-1-ium-2-carboxylate dichloride Openeye Name: 2-pyrrolidin-1-ium-1-ylethyl 1H-indol-1-ium-2-carboxylate dichloride CAS Name: 1H-indol-1-ium-2-carboxylic acid 2-(1-pyrrolidin-1-iumyl)ethyl ester dichloride IUPAC Name: 2-pyrrolidin-1-ium-1-ylethyl 1H-indol-1-ium-2-carboxylate dichloride Traditional Name: 1H-indol-1-ium-2-carboxylic acid 2-pyrrolidin-1-ium-1-ylethyl ester dichloride Formula: C15H20Cl2N2O2 MolecularWeight: 331.2375

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC(=O)C2=CC3=CC=CC=C3[NH2+]2.[Cl-].[Cl-]

Isomeric SMILES

C1CC[NH+](C1)CCOC(=O)C2=CC3=CC=CC=C3[NH2+]2.[Cl-].[Cl-]

InChI

InChI=1S/C15H18N2O2.2ClH/c18-15(19-10-9-17-7-3-4-8-17)14-11-12-5-1-2-6-13(12)16-14;;/h1-2,5-6,11,16H,3-4,7-10H2;2*1H