4-[5-methoxy-1-(4-methylphenyl)sulfonyl-indazol-3-yl]oxy-1-(4-methoxyphenyl)butan-1-one

Systemtic Name: 4-[5-methoxy-1-(4-methylphenyl)sulfonyl-indazol-3-yl]oxy-1-(4-methoxyphenyl)butan-1-one Openeye Name: 1-(4-methoxyphenyl)-4-[5-methoxy-1-(p-tolylsulfonyl)indazol-3-yl]oxy-butan-1-one CAS Name: 4-[[5-methoxy-1-(4-methylphenyl)sulfonyl-3-indazolyl]oxy]-1-(4-methoxyphenyl)-1-butanone IUPAC Name: 4-[5-methoxy-1-(4-methylphenyl)sulfonylindazol-3-yl]oxy-1-(4-methoxyphenyl)butan-1-one Traditional Name: 1-(4-methoxyphenyl)-4-(5-methoxy-1-tosyl-indazol-3-yl)oxy-butan-1-one Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)OC)C(=N2)OCCCC(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)OC)C(=N2)OCCCC(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H26N2O6S/c1-18-6-13-22(14-7-18)35(30,31)28-24-15-12-21(33-3)17-23(24)26(27-28)34-16-4-5-25(29)19-8-10-20(32-2)11-9-19/h6-15,17H,4-5,16H2,1-3H3