N-[2-(1H-indol-3-yl)ethyl]-1-[(3-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-1-[(3-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-hydroxy-3-methoxy-phenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-hydroxy-3-methoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-hydroxy-3-methoxyphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-hydroxy-3-methoxy-benzyl)-N-[2-(1H-indol-3-yl)ethyl]piperidin-1-ium-4-carboxamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H29N3O3/c1-30-22-8-4-5-19(23(22)28)16-27-13-10-17(11-14-27)24(29)25-12-9-18-15-26-21-7-3-2-6-20(18)21/h2-8,15,17,26,28H,9-14,16H2,1H3,(H,25,29)/p+1