methyl-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)-1,3-dihydroinden-2-yl]-(phenylmethyl)azanium

Systemtic Name: methyl-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)-1,3-dihydroinden-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)indan-2-yl]ammonium CAS Name: methyl-[2-[[2-(4-morpholin-4-iumyl)ethylamino]-oxomethyl]-1,3-dihydroinden-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)-1,3-dihydroinden-2-yl]azanium Traditional Name: benzyl-methyl-[2-(2-morpholin-4-ium-4-ylethylcarbamoyl)indan-2-yl]ammonium Formula: C24H33N3O2+2 MolecularWeight: 395.53772

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C24H31N3O2/c1-26(19-20-7-3-2-4-8-20)24(17-21-9-5-6-10-22(21)18-24)23(28)25-11-12-27-13-15-29-16-14-27/h2-10H,11-19H2,1H3,(H,25,28)/p+2