methyl-(phenylmethyl)-[2-[(1H-pyrazol-4-ylcarbonylamino)methyl]-1,3-dihydroinden-2-yl]azanium

Systemtic Name: methyl-(phenylmethyl)-[2-[(1H-pyrazol-4-ylcarbonylamino)methyl]-1,3-dihydroinden-2-yl]azanium Openeye Name: benzyl-methyl-[2-[(1H-pyrazole-4-carbonylamino)methyl]indan-2-yl]ammonium CAS Name: methyl-[2-[[[oxo(1H-pyrazol-4-yl)methyl]amino]methyl]-1,3-dihydroinden-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[2-[(1H-pyrazole-4-carbonylamino)methyl]-1,3-dihydroinden-2-yl]azanium Traditional Name: benzyl-methyl-[2-[(1H-pyrazole-4-carbonylamino)methyl]indan-2-yl]ammonium Formula: C22H25N4O+ MolecularWeight: 361.4601

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)CNC(=O)C4=CNN=C4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)CNC(=O)C4=CNN=C4

InChI

InChI=1S/C22H24N4O/c1-26(15-17-7-3-2-4-8-17)22(11-18-9-5-6-10-19(18)12-22)16-23-21(27)20-13-24-25-14-20/h2-10,13-14H,11-12,15-16H2,1H3,(H,23,27)(H,24,25)/p+1