1,3-benzodioxol-4-ylmethyl-[(4S)-1-(3-fluorophenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium

Systemtic Name: 1,3-benzodioxol-4-ylmethyl-[(4S)-1-(3-fluorophenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Openeye Name: 1,3-benzodioxol-4-ylmethyl-[(4S)-1-(3-fluorophenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium CAS Name: 1,3-benzodioxol-4-ylmethyl-[(4S)-1-(3-fluorophenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium IUPAC Name: 1,3-benzodioxol-4-ylmethyl-[(4S)-1-(3-fluorophenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Traditional Name: 1,3-benzodioxol-4-ylmethyl-[(4S)-1-(3-fluorophenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium Formula: C23H25FN3O2+ MolecularWeight: 394.461903

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(C1)N(N=C2)C3=CC(=CC=C3)F)[NH2+]CC4=C5C(=CC=C4)OCO5)C

Isomeric SMILES

CC1(C[C@@H](C2=C(C1)N(N=C2)C3=CC(=CC=C3)F)[NH2+]CC4=C5C(=CC=C4)OCO5)C

InChI

InChI=1S/C23H24FN3O2/c1-23(2)10-19(25-12-15-5-3-8-21-22(15)29-14-28-21)18-13-26-27(20(18)11-23)17-7-4-6-16(24)9-17/h3-9,13,19,25H,10-12,14H2,1-2H3/p+1/t19-/m0/s1