1-[(E)-3-oxidanylideneprop-1-enyl]-6,6-dipyridin-4-yl-7H-indazole-3-carboxylic acid

Systemtic Name: 1-[(E)-3-oxidanylideneprop-1-enyl]-6,6-dipyridin-4-yl-7H-indazole-3-carboxylic acid Openeye Name: 1-[(E)-3-oxoprop-1-enyl]-6,6-bis(4-pyridyl)-7H-indazole-3-carboxylic acid CAS Name: 1-[(E)-3-oxoprop-1-enyl]-6,6-dipyridin-4-yl-7H-indazole-3-carboxylic acid IUPAC Name: 1-[(E)-3-oxoprop-1-enyl]-6,6-dipyridin-4-yl-7H-indazole-3-carboxylic acid Traditional Name: 1-[(E)-3-ketoprop-1-enyl]-6,6-bis(4-pyridyl)-7H-indazole-3-carboxylic acid Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC1(C3=CC=NC=C3)C4=CC=NC=C4)C(=NN2C=CC=O)C(=O)O

Isomeric SMILES

C1C2=C(C=CC1(C3=CC=NC=C3)C4=CC=NC=C4)C(=NN2/C=C/C=O)C(=O)O

InChI

InChI=1S/C21H16N4O3/c26-13-1-12-25-18-14-21(15-3-8-22-9-4-15,16-5-10-23-11-6-16)7-2-17(18)19(24-25)20(27)28/h1-13H,14H2,(H,27,28)/b12-1+