5-[2-(3-carboxyphenyl)-5-(4-dimethylaminophenyl)imino-4-methyl-3,6-bis(oxidanylidene)pyrazolo[3,4-b]pyridin-7-yl]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[2-(3-carboxyphenyl)-5-(4-dimethylaminophenyl)imino-4-methyl-3,6-bis(oxidanylidene)pyrazolo[3,4-b]pyridin-7-yl]benzene-1,3-dicarboxylic acid Openeye Name: 5-[2-(3-carboxyphenyl)-5-(4-dimethylaminophenyl)imino-4-methyl-3,6-dioxo-pyrazolo[3,4-b]pyridin-7-yl]benzene-1,3-dicarboxylic acid CAS Name: 5-[2-(3-carboxyphenyl)-5-(4-dimethylaminophenyl)imino-4-methyl-3,6-dioxo-7-pyrazolo[3,4-b]pyridinyl]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[2-(3-carboxyphenyl)-5-(4-dimethylaminophenyl)imino-4-methyl-3,6-dioxopyrazolo[3,4-b]pyridin-7-yl]benzene-1,3-dicarboxylic acid Traditional Name: 5-[2-(3-carboxyphenyl)-5-(4-dimethylaminophenyl)imino-3,6-diketo-4-methyl-pyrazolo[3,4-b]pyridin-7-yl]isophthalic acid Formula: C30H23N5O8 MolecularWeight: 581.53232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C2=O)C3=CC=CC(=C3)C(=O)O)N(C(=O)C1=NC4=CC=C(C=C4)N(C)C)C5=CC(=CC(=C5)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C2C(=NN(C2=O)C3=CC=CC(=C3)C(=O)O)N(C(=O)C1=NC4=CC=C(C=C4)N(C)C)C5=CC(=CC(=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C30H23N5O8/c1-15-23-25(32-35(26(23)36)21-6-4-5-16(12-21)28(38)39)34(22-13-17(29(40)41)11-18(14-22)30(42)43)27(37)24(15)31-19-7-9-20(10-8-19)33(2)3/h4-14H,1-3H3,(H,38,39)(H,40,41)(H,42,43)