4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide Openeye Name: 4-indan-5-yl-4-oxo-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide CAS Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-oxo-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]butanamide IUPAC Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-oxo-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide Traditional Name: 4-indan-5-yl-4-keto-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]butyramide Formula: C26H33N2O2+ MolecularWeight: 405.55242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCC(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CCC(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C26H32N2O2/c29-25(24-12-11-22-5-4-6-23(22)17-24)13-14-26(30)27-18-20-7-9-21(10-8-20)19-28-15-2-1-3-16-28/h7-12,17H,1-6,13-16,18-19H2,(H,27,30)/p+1