methyl 1,6-dimethyl-4-(3-nitrophenyl)-3-prop-2-enyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: methyl 1,6-dimethyl-4-(3-nitrophenyl)-3-prop-2-enyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: methyl 3-allyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1,6-dimethyl-4-(3-nitrophenyl)-3-prop-2-enyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester IUPAC Name: methyl 1,6-dimethyl-4-(3-nitrophenyl)-3-prop-2-enyl-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 3-allyl-1,6-dimethyl-4-(3-nitrophenyl)-2,4-dihydropyrazolo[3,4-b]pyridine-5-carboxylic acid methyl ester Formula: C19H20N4O4 MolecularWeight: 368.3865

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(NN(C2=N1)C)CC=C)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(NN(C2=N1)C)CC=C)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H20N4O4/c1-5-7-14-17-16(12-8-6-9-13(10-12)23(25)26)15(19(24)27-4)11(2)20-18(17)22(3)21-14/h5-6,8-10,16,21H,1,7H2,2-4H3