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

Systemtic Name: N-[1-(phenethylcarbamoyl)-1-propan-2-yl-piperidin-1-ium-2-yl]-1H-indole-2-carboxamide Openeye Name: N-[1-isopropyl-1-(phenethylcarbamoyl)piperidin-1-ium-2-yl]-1H-indole-2-carboxamide CAS Name: N-[1-[oxo-(phenethylamino)methyl]-1-propan-2-yl-2-piperidin-1-iumyl]-1H-indole-2-carboxamide IUPAC Name: N-[1-(phenethylcarbamoyl)-1-propan-2-ylpiperidin-1-ium-2-yl]-1H-indole-2-carboxamide Traditional Name: N-[1-isopropyl-1-(phenethylcarbamoyl)piperidin-1-ium-2-yl]-1H-indole-2-carboxamide Formula: C26H33N4O2+ MolecularWeight: 433.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(CCCCC1NC(=O)C2=CC3=CC=CC=C3N2)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)[N+]1(CCCCC1NC(=O)C2=CC3=CC=CC=C3N2)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2/c1-19(2)30(26(32)27-16-15-20-10-4-3-5-11-20)17-9-8-14-24(30)29-25(31)23-18-21-12-6-7-13-22(21)28-23/h3-7,10-13,18-19,24H,8-9,14-17H2,1-2H3,(H2-,27,28,29,31,32)/p+1