[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-(1-ethylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-(1-ethylpiperidin-1-ium-4-yl)azanium Openeye Name: [(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-(1-ethylpiperidin-1-ium-4-yl)ammonium CAS Name: [(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-(1-ethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-(1-ethylpiperidin-1-ium-4-yl)azanium Traditional Name: [(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-(1-ethylpiperidin-1-ium-4-yl)ammonium Formula: C22H34N4+2 MolecularWeight: 354.53216

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)[NH2+]C2CC(CC3=C2C=NN3C4=CC=CC=C4)(C)C

Isomeric SMILES

CC[NH+]1CCC(CC1)[NH2+][C@H]2CC(CC3=C2C=NN3C4=CC=CC=C4)(C)C

InChI

InChI=1S/C22H32N4/c1-4-25-12-10-17(11-13-25)24-20-14-22(2,3)15-21-19(20)16-23-26(21)18-8-6-5-7-9-18/h5-9,16-17,20,24H,4,10-15H2,1-3H3/p+2/t20-/m0/s1