2,3-dihydro-1H-inden-5-yl-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: 2,3-dihydro-1H-inden-5-yl-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-indan-5-yl-methanone CAS Name: 2,3-dihydro-1H-inden-5-yl-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(2,3-dihydro-1H-inden-5-yl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-indan-5-yl-methanone Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N2O/c24-21(20-10-9-18-7-4-8-19(18)15-20)23-13-11-22(12-14-23)16-17-5-2-1-3-6-17/h1-3,5-6,9-10,15H,4,7-8,11-14,16H2/p+1