(E)-3-[3-(cyclobutylamino)-6,6-bis(4-dimethylaminophenyl)-7H-indazol-1-yl]prop-2-enal

Systemtic Name: (E)-3-[3-(cyclobutylamino)-6,6-bis(4-dimethylaminophenyl)-7H-indazol-1-yl]prop-2-enal Openeye Name: (E)-3-[3-(cyclobutylamino)-6,6-bis(4-dimethylaminophenyl)-7H-indazol-1-yl]prop-2-enal CAS Name: (E)-3-[3-(cyclobutylamino)-6,6-bis(4-dimethylaminophenyl)-7H-indazol-1-yl]-2-propenal IUPAC Name: (E)-3-[3-(cyclobutylamino)-6,6-bis(4-dimethylaminophenyl)-7H-indazol-1-yl]prop-2-enal Traditional Name: (E)-3-[3-(cyclobutylamino)-6,6-bis(4-dimethylaminophenyl)-7H-indazol-1-yl]acrolein Formula: C30H35N5O MolecularWeight: 481.6318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2(CC3=C(C=C2)C(=NN3C=CC=O)NC4CCC4)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2(CC3=C(C=C2)C(=NN3/C=C/C=O)NC4CCC4)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C30H35N5O/c1-33(2)25-13-9-22(10-14-25)30(23-11-15-26(16-12-23)34(3)4)18-17-27-28(21-30)35(19-6-20-36)32-29(27)31-24-7-5-8-24/h6,9-20,24H,5,7-8,21H2,1-4H3,(H,31,32)/b19-6+