[2-[[(5-methoxy-5-oxidanylidene-pentanoyl)amino]methyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[[(5-methoxy-5-oxidanylidene-pentanoyl)amino]methyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[[(5-methoxy-5-oxo-pentanoyl)amino]methyl]indan-2-yl]-methyl-ammonium CAS Name: [2-[[(5-methoxy-1,5-dioxopentyl)amino]methyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[[(5-methoxy-5-oxopentanoyl)amino]methyl]-1,3-dihydroinden-2-yl]-methylazanium Traditional Name: benzyl-[2-[[(5-keto-5-methoxy-pentanoyl)amino]methyl]indan-2-yl]-methyl-ammonium Formula: C24H31N2O3+ MolecularWeight: 395.51454

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)CNC(=O)CCCC(=O)OC

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)CNC(=O)CCCC(=O)OC

InChI

InChI=1S/C24H30N2O3/c1-26(17-19-9-4-3-5-10-19)24(15-20-11-6-7-12-21(20)16-24)18-25-22(27)13-8-14-23(28)29-2/h3-7,9-12H,8,13-18H2,1-2H3,(H,25,27)/p+1