N-[1-(phenethylcarbamoyl)-1-propan-2-yl-piperidin-1-ium-2-yl]-1H-indole-6-carboxamide

Systemtic Name: N-[1-(phenethylcarbamoyl)-1-propan-2-yl-piperidin-1-ium-2-yl]-1H-indole-6-carboxamide Openeye Name: N-[1-isopropyl-1-(phenethylcarbamoyl)piperidin-1-ium-2-yl]-1H-indole-6-carboxamide CAS Name: N-[1-[oxo-(phenethylamino)methyl]-1-propan-2-yl-2-piperidin-1-iumyl]-1H-indole-6-carboxamide IUPAC Name: N-[1-(phenethylcarbamoyl)-1-propan-2-ylpiperidin-1-ium-2-yl]-1H-indole-6-carboxamide Traditional Name: N-[1-isopropyl-1-(phenethylcarbamoyl)piperidin-1-ium-2-yl]-1H-indole-6-carboxamide Formula: C26H33N4O2+ MolecularWeight: 433.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(CCCCC1NC(=O)C2=CC3=C(C=C2)C=CN3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)[N+]1(CCCCC1NC(=O)C2=CC3=C(C=C2)C=CN3)C(=O)NCCC4=CC=CC=C4

InChI

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