2-[1-[5-chloranyl-1-(phenylmethyl)indazol-3-yl]oxybutan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-[5-chloranyl-1-(phenylmethyl)indazol-3-yl]oxybutan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-[(1-benzyl-5-chloro-indazol-3-yl)oxymethyl]propyl]isoindoline-1,3-dione CAS Name: 2-[1-[[5-chloro-1-(phenylmethyl)-3-indazolyl]oxy]butan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(1-benzyl-5-chloroindazol-3-yl)oxybutan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-[(1-benzyl-5-chloro-indazol-3-yl)oxymethyl]propyl]isoindoline-1,3-quinone Formula: C26H22ClN3O3 MolecularWeight: 459.92418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=NN(C2=C1C=C(C=C2)Cl)CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCC(COC1=NN(C2=C1C=C(C=C2)Cl)CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H22ClN3O3/c1-2-19(30-25(31)20-10-6-7-11-21(20)26(30)32)16-33-24-22-14-18(27)12-13-23(22)29(28-24)15-17-8-4-3-5-9-17/h3-14,19H,2,15-16H2,1H3