(2S)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(phenylmethyl)propanamide

Systemtic Name: (2S)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(phenylmethyl)propanamide Openeye Name: (2S)-N-benzyl-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]propanamide CAS Name: (2S)-2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-N-(phenylmethyl)propanamide IUPAC Name: (2S)-N-benzyl-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-benzyl-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]propionamide Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=C1)[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O/c1-17(23(27)25-15-18-7-3-2-4-8-18)26-13-11-19(12-14-26)21-16-24-22-10-6-5-9-20(21)22/h2-10,16-17,19,24H,11-15H2,1H3,(H,25,27)/p+1/t17-/m0/s1