2-[3-[[(3S)-3-(2-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]methyl]indol-1-yl]ethanamide

Systemtic Name: 2-[3-[[(3S)-3-(2-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]methyl]indol-1-yl]ethanamide Openeye Name: 2-[3-[[(3S)-3-(2-methoxybenzoyl)piperidin-1-ium-1-yl]methyl]indol-1-yl]acetamide CAS Name: 2-[3-[[(3S)-3-[(2-methoxyphenyl)-oxomethyl]-1-piperidin-1-iumyl]methyl]-1-indolyl]acetamide IUPAC Name: 2-[3-[[(3S)-3-(2-methoxybenzoyl)piperidin-1-ium-1-yl]methyl]indol-1-yl]acetamide Traditional Name: 2-[3-[[(3S)-3-o-anisoylpiperidin-1-ium-1-yl]methyl]indol-1-yl]acetamide Formula: C24H28N3O3+ MolecularWeight: 406.49742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)C2CCC[NH+](C2)CC3=CN(C4=CC=CC=C43)CC(=O)N

Isomeric SMILES

COC1=CC=CC=C1C(=O)[C@H]2CCC[NH+](C2)CC3=CN(C4=CC=CC=C43)CC(=O)N

InChI

InChI=1S/C24H27N3O3/c1-30-22-11-5-3-9-20(22)24(29)17-7-6-12-26(13-17)14-18-15-27(16-23(25)28)21-10-4-2-8-19(18)21/h2-5,8-11,15,17H,6-7,12-14,16H2,1H3,(H2,25,28)/p+1/t17-/m0/s1