(3-ethanoylphenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium

Systemtic Name: (3-ethanoylphenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Openeye Name: (3-acetylphenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium CAS Name: (3-acetylphenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium IUPAC Name: (3-acetylphenyl)methyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Traditional Name: (3-acetylbenzyl)-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium Formula: C25H30N3O2+ MolecularWeight: 404.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C[NH2+]C2CC(CC3=C2C=NN3C4=CC=C(C=C4)OC)(C)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C[NH2+][C@@H]2CC(CC3=C2C=NN3C4=CC=C(C=C4)OC)(C)C

InChI

InChI=1S/C25H29N3O2/c1-17(29)19-7-5-6-18(12-19)15-26-23-13-25(2,3)14-24-22(23)16-27-28(24)20-8-10-21(30-4)11-9-20/h5-12,16,23,26H,13-15H2,1-4H3/p+1/t23-/m1/s1