N-[[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide Openeye Name: N-[[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide CAS Name: N-[[(3R)-1-(1H-indol-3-ylmethyl)-3-piperidin-1-iumyl]methyl]-3,5-dimethoxybenzamide IUPAC Name: N-[[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxybenzamide Traditional Name: N-[[(3R)-1-(1H-indol-3-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC2CCC[NH+](C2)CC3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC[C@H]2CCC[NH+](C2)CC3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C24H29N3O3/c1-29-20-10-18(11-21(12-20)30-2)24(28)26-13-17-6-5-9-27(15-17)16-19-14-25-23-8-4-3-7-22(19)23/h3-4,7-8,10-12,14,17,25H,5-6,9,13,15-16H2,1-2H3,(H,26,28)/p+1/t17-/m1/s1