(2S)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide Openeye Name: (2S)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide CAS Name: (2S)-2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-N-(2-methoxy-5-methylphenyl)propanamide IUPAC Name: (2S)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(2-methoxy-5-methylphenyl)propanamide Traditional Name: (2S)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propionamide Formula: C24H30N3O2+ MolecularWeight: 392.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](C)[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H29N3O2/c1-16-8-9-23(29-3)22(14-16)26-24(28)17(2)27-12-10-18(11-13-27)20-15-25-21-7-5-4-6-19(20)21/h4-9,14-15,17-18,25H,10-13H2,1-3H3,(H,26,28)/p+1/t17-/m0/s1