[4-(2-hydroxyethyl)piperazin-1-yl]-(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)methanone

Systemtic Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)methanone Openeye Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-piperidin-1-ium-1-ylindan-2-yl)methanone CAS Name: [4-(2-hydroxyethyl)-1-piperazinyl]-[2-(1-piperidin-1-iumyl)-1,3-dihydroinden-2-yl]methanone IUPAC Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)methanone Traditional Name: [4-(2-hydroxyethyl)piperazino]-(2-piperidin-1-ium-1-ylindan-2-yl)methanone Formula: C21H32N3O2+ MolecularWeight: 358.49768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)N4CCN(CC4)CCO

Isomeric SMILES

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)N4CCN(CC4)CCO

InChI

InChI=1S/C21H31N3O2/c25-15-14-22-10-12-23(13-11-22)20(26)21(24-8-4-1-5-9-24)16-18-6-2-3-7-19(18)17-21/h2-3,6-7,25H,1,4-5,8-17H2/p+1