[2-[(1,5-dimethylpyrazol-4-yl)methylcarbamoyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[(1,5-dimethylpyrazol-4-yl)methylcarbamoyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(1,5-dimethylpyrazol-4-yl)methylcarbamoyl]indan-2-yl]-methyl-ammonium CAS Name: [2-[[(1,5-dimethyl-4-pyrazolyl)methylamino]-oxomethyl]-1,3-dihydroinden-2-yl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(1,5-dimethylpyrazol-4-yl)methylcarbamoyl]-1,3-dihydroinden-2-yl]-methylazanium Traditional Name: benzyl-[2-[(1,5-dimethylpyrazol-4-yl)methylcarbamoyl]indan-2-yl]-methyl-ammonium Formula: C24H29N4O+ MolecularWeight: 389.51326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CNC(=O)C2(CC3=CC=CC=C3C2)[NH+](C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=NN1C)CNC(=O)C2(CC3=CC=CC=C3C2)[NH+](C)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O/c1-18-22(16-26-28(18)3)15-25-23(29)24(13-20-11-7-8-12-21(20)14-24)27(2)17-19-9-5-4-6-10-19/h4-12,16H,13-15,17H2,1-3H3,(H,25,29)/p+1