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

Systemtic Name: (E)-3-[3-(cyclopropylamino)-6,6-bis(4-methoxyphenyl)-7H-indazol-1-yl]prop-2-enal Openeye Name: (E)-3-[3-(cyclopropylamino)-6,6-bis(4-methoxyphenyl)-7H-indazol-1-yl]prop-2-enal CAS Name: (E)-3-[3-(cyclopropylamino)-6,6-bis(4-methoxyphenyl)-7H-indazol-1-yl]-2-propenal IUPAC Name: (E)-3-[3-(cyclopropylamino)-6,6-bis(4-methoxyphenyl)-7H-indazol-1-yl]prop-2-enal Traditional Name: (E)-3-[3-(cyclopropylamino)-6,6-bis(4-methoxyphenyl)-7H-indazol-1-yl]acrolein Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC3=C(C=C2)C(=NN3C=CC=O)NC4CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC3=C(C=C2)C(=NN3/C=C/C=O)NC4CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H27N3O3/c1-32-22-10-4-19(5-11-22)27(20-6-12-23(33-2)13-7-20)15-14-24-25(18-27)30(16-3-17-31)29-26(24)28-21-8-9-21/h3-7,10-17,21H,8-9,18H2,1-2H3,(H,28,29)/b16-3+