6-chloranyl-7-methoxy-1-(4-methylsulfonylphenyl)benzo[g]indazole-3-carbonitrile

Systemtic Name: 6-chloranyl-7-methoxy-1-(4-methylsulfonylphenyl)benzo[g]indazole-3-carbonitrile Openeye Name: 6-chloro-7-methoxy-1-(4-methylsulfonylphenyl)benzo[g]indazole-3-carbonitrile CAS Name: 6-chloro-7-methoxy-1-(4-methylsulfonylphenyl)-3-benzo[g]indazolecarbonitrile IUPAC Name: 6-chloro-7-methoxy-1-(4-methylsulfonylphenyl)benzo[g]indazole-3-carbonitrile Traditional Name: 6-chloro-1-(4-mesylphenyl)-7-methoxy-benz[g]indazole-3-carbonitrile Formula: C20H14ClN3O3S MolecularWeight: 411.86146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3=C(C=C2)C(=NN3C4=CC=C(C=C4)S(=O)(=O)C)C#N)Cl

Isomeric SMILES

COC1=C(C2=C(C=C1)C3=C(C=C2)C(=NN3C4=CC=C(C=C4)S(=O)(=O)C)C#N)Cl

InChI

InChI=1S/C20H14ClN3O3S/c1-27-18-10-9-15-14(19(18)21)7-8-16-17(11-22)23-24(20(15)16)12-3-5-13(6-4-12)28(2,25)26/h3-10H,1-2H3