8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-2-propan-2-yl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-2-propan-2-yl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-2-isopropyl-4-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-[(1,3-diphenyl-4-pyrazolyl)methyl]-4-methyl-2-propan-2-yl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-4-methyl-2-propan-2-yl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-[(1,3-diphenylpyrazol-4-yl)methyl]-2-isopropyl-4-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C27H32N5O2+ MolecularWeight: 458.57528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2(CC[NH+](CC2)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)N(C1=O)C

Isomeric SMILES

CC(C)N1C(=O)C2(CC[NH+](CC2)CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)N(C1=O)C

InChI

InChI=1S/C27H31N5O2/c1-20(2)32-25(33)27(29(3)26(32)34)14-16-30(17-15-27)18-22-19-31(23-12-8-5-9-13-23)28-24(22)21-10-6-4-7-11-21/h4-13,19-20H,14-18H2,1-3H3/p+1