(4-methoxy-2,3-dimethyl-phenyl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium

Systemtic Name: (4-methoxy-2,3-dimethyl-phenyl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Openeye Name: (4-methoxy-2,3-dimethyl-phenyl)methyl-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium CAS Name: (4-methoxy-2,3-dimethylphenyl)methyl-[(4S)-1-(2-pyridinyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium IUPAC Name: (4-methoxy-2,3-dimethylphenyl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Traditional Name: (4-methoxy-2,3-dimethyl-benzyl)-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC)C[NH2+]C2CCCC3=C2C=NN3C4=CC=CC=N4

Isomeric SMILES

CC1=C(C=CC(=C1C)OC)C[NH2+][C@H]2CCCC3=C2C=NN3C4=CC=CC=N4

InChI

InChI=1S/C22H26N4O/c1-15-16(2)21(27-3)11-10-17(15)13-24-19-7-6-8-20-18(19)14-25-26(20)22-9-4-5-12-23-22/h4-5,9-12,14,19,24H,6-8,13H2,1-3H3/p+1/t19-/m0/s1