5-chloranyl-N-[1-(phenethylcarbamoyl)-1-propan-2-yl-piperidin-1-ium-2-yl]-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-N-[1-(phenethylcarbamoyl)-1-propan-2-yl-piperidin-1-ium-2-yl]-1H-indole-2-carboxamide Openeye Name: 5-chloro-N-[1-isopropyl-1-(phenethylcarbamoyl)piperidin-1-ium-2-yl]-1H-indole-2-carboxamide CAS Name: 5-chloro-N-[1-[oxo-(phenethylamino)methyl]-1-propan-2-yl-2-piperidin-1-iumyl]-1H-indole-2-carboxamide IUPAC Name: 5-chloro-N-[1-(phenethylcarbamoyl)-1-propan-2-ylpiperidin-1-ium-2-yl]-1H-indole-2-carboxamide Traditional Name: 5-chloro-N-[1-isopropyl-1-(phenethylcarbamoyl)piperidin-1-ium-2-yl]-1H-indole-2-carboxamide Formula: C26H32ClN4O2+ MolecularWeight: 468.01088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(CCCCC1NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)[N+]1(CCCCC1NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H31ClN4O2/c1-18(2)31(26(33)28-14-13-19-8-4-3-5-9-19)15-7-6-10-24(31)30-25(32)23-17-20-16-21(27)11-12-22(20)29-23/h3-5,8-9,11-12,16-18,24H,6-7,10,13-15H2,1-2H3,(H2-,28,29,30,32,33)/p+1