(3S)-N-[3-(1H-indol-2-yl)phenyl]-1-propan-2-yl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-[3-(1H-indol-2-yl)phenyl]-1-propan-2-yl-piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[3-(1H-indol-2-yl)phenyl]-1-isopropyl-piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[3-(1H-indol-2-yl)phenyl]-1-propan-2-yl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-[3-(1H-indol-2-yl)phenyl]-1-propan-2-ylpiperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[3-(1H-indol-2-yl)phenyl]-1-isopropyl-piperidin-1-ium-3-carboxamide Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCCC(C1)C(=O)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CC(C)[NH+]1CCC[C@@H](C1)C(=O)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C23H27N3O/c1-16(2)26-12-6-9-19(15-26)23(27)24-20-10-5-8-17(13-20)22-14-18-7-3-4-11-21(18)25-22/h3-5,7-8,10-11,13-14,16,19,25H,6,9,12,15H2,1-2H3,(H,24,27)/p+1/t19-/m0/s1