N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-2,3-dimethoxy-benzamide

Systemtic Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-2,3-dimethoxy-benzamide Openeye Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-2,3-dimethoxy-benzamide CAS Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]-2,3-dimethoxybenzamide IUPAC Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-2,3-dimethoxybenzamide Traditional Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-2,3-dimethoxy-benzamide Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)NC2CCC[NH+](C2)C3CC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)N[C@H]2CCC[NH+](C2)C3CC4=CC=CC=C4C3

InChI

InChI=1S/C23H28N2O3/c1-27-21-11-5-10-20(22(21)28-2)23(26)24-18-9-6-12-25(15-18)19-13-16-7-3-4-8-17(16)14-19/h3-5,7-8,10-11,18-19H,6,9,12-15H2,1-2H3,(H,24,26)/p+1/t18-/m0/s1