2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-6-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-6-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-methyl-6-oxo-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl]azanium Traditional Name: homoveratryl-[(6-keto-3-methyl-1-phenyl-2H-pyrazolo[3,4-b]pyridin-5-yl)methyl]ammonium Formula: C24H27N4O3+ MolecularWeight: 419.49618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)C[NH2+]CCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)C[NH2+]CCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H26N4O3/c1-16-20-14-18(15-25-12-11-17-9-10-21(30-2)22(13-17)31-3)24(29)26-23(20)28(27-16)19-7-5-4-6-8-19/h4-10,13-14,25,27H,11-12,15H2,1-3H3/p+1