(E)-3-[6-(1,3-benzodioxol-5-yl)-6-phenyl-3-phenylazanyl-7H-indazol-1-yl]prop-2-enal

Systemtic Name: (E)-3-[6-(1,3-benzodioxol-5-yl)-6-phenyl-3-phenylazanyl-7H-indazol-1-yl]prop-2-enal Openeye Name: (E)-3-[3-anilino-6-(1,3-benzodioxol-5-yl)-6-phenyl-7H-indazol-1-yl]prop-2-enal CAS Name: (E)-3-[3-anilino-6-(1,3-benzodioxol-5-yl)-6-phenyl-7H-indazol-1-yl]-2-propenal IUPAC Name: (E)-3-[3-anilino-6-(1,3-benzodioxol-5-yl)-6-phenyl-7H-indazol-1-yl]prop-2-enal Traditional Name: (E)-3-[3-anilino-6-(1,3-benzodioxol-5-yl)-6-phenyl-7H-indazol-1-yl]acrolein Formula: C29H23N3O3 MolecularWeight: 461.51122

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC1(C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5)C(=NN2C=CC=O)NC6=CC=CC=C6

Isomeric SMILES

C1C2=C(C=CC1(C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5)C(=NN2/C=C/C=O)NC6=CC=CC=C6

InChI

InChI=1S/C29H23N3O3/c33-17-7-16-32-25-19-29(21-8-3-1-4-9-21,22-12-13-26-27(18-22)35-20-34-26)15-14-24(25)28(31-32)30-23-10-5-2-6-11-23/h1-18H,19-20H2,(H,30,31)/b16-7+