[2-(2-acetamidoethylcarbamoyl)-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-(2-acetamidoethylcarbamoyl)-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium Openeye Name: [2-(2-acetamidoethylcarbamoyl)indan-2-yl]-benzyl-methyl-ammonium CAS Name: [2-[(2-acetamidoethylamino)-oxomethyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)ammonium IUPAC Name: [2-(2-acetamidoethylcarbamoyl)-1,3-dihydroinden-2-yl]-benzyl-methylazanium Traditional Name: [2-(2-acetamidoethylcarbamoyl)indan-2-yl]-benzyl-methyl-ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1(CC2=CC=CC=C2C1)[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC(=O)C1(CC2=CC=CC=C2C1)[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-17(26)23-12-13-24-21(27)22(14-19-10-6-7-11-20(19)15-22)25(2)16-18-8-4-3-5-9-18/h3-11H,12-16H2,1-2H3,(H,23,26)(H,24,27)/p+1