(E)-3-(6-phenyl-3-phenylazanyl-6-pyridin-4-yl-7H-indazol-1-yl)prop-2-enal

Systemtic Name: (E)-3-(6-phenyl-3-phenylazanyl-6-pyridin-4-yl-7H-indazol-1-yl)prop-2-enal Openeye Name: (E)-3-[3-anilino-6-phenyl-6-(4-pyridyl)-7H-indazol-1-yl]prop-2-enal CAS Name: (E)-3-(3-anilino-6-phenyl-6-pyridin-4-yl-7H-indazol-1-yl)-2-propenal IUPAC Name: (E)-3-(3-anilino-6-phenyl-6-pyridin-4-yl-7H-indazol-1-yl)prop-2-enal Traditional Name: (E)-3-[3-anilino-6-phenyl-6-(4-pyridyl)-7H-indazol-1-yl]acrolein Formula: C27H22N4O MolecularWeight: 418.48978

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC1(C3=CC=CC=C3)C4=CC=NC=C4)C(=NN2C=CC=O)NC5=CC=CC=C5

Isomeric SMILES

C1C2=C(C=CC1(C3=CC=CC=C3)C4=CC=NC=C4)C(=NN2/C=C/C=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H22N4O/c32-19-7-18-31-25-20-27(21-8-3-1-4-9-21,22-13-16-28-17-14-22)15-12-24(25)26(30-31)29-23-10-5-2-6-11-23/h1-19H,20H2,(H,29,30)/b18-7+