3-(4-chlorophenyl)-5-ethyl-1-methyl-N-(2-piperidin-1-ium-1-ylethyl)indole-2-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-5-ethyl-1-methyl-N-(2-piperidin-1-ium-1-ylethyl)indole-2-carboxamide Openeye Name: 3-(4-chlorophenyl)-5-ethyl-1-methyl-N-(2-piperidin-1-ium-1-ylethyl)indole-2-carboxamide CAS Name: 3-(4-chlorophenyl)-5-ethyl-1-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]-2-indolecarboxamide IUPAC Name: 3-(4-chlorophenyl)-5-ethyl-1-methyl-N-(2-piperidin-1-ium-1-ylethyl)indole-2-carboxamide Traditional Name: 3-(4-chlorophenyl)-5-ethyl-1-methyl-N-(2-piperidin-1-ium-1-ylethyl)indole-2-carboxamide Formula: C25H31ClN3O+ MolecularWeight: 424.98614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=C2C3=CC=C(C=C3)Cl)C(=O)NCC[NH+]4CCCCC4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=C2C3=CC=C(C=C3)Cl)C(=O)NCC[NH+]4CCCCC4)C

InChI

InChI=1S/C25H30ClN3O/c1-3-18-7-12-22-21(17-18)23(19-8-10-20(26)11-9-19)24(28(22)2)25(30)27-13-16-29-14-5-4-6-15-29/h7-12,17H,3-6,13-16H2,1-2H3,(H,27,30)/p+1