5-(3-cyclopentyloxy-4-methoxy-phenyl)-3-oxidanylidene-3a,4,6,7-tetrahydro-2H-indazole-5-carbonitrile

Systemtic Name: 5-(3-cyclopentyloxy-4-methoxy-phenyl)-3-oxidanylidene-3a,4,6,7-tetrahydro-2H-indazole-5-carbonitrile Openeye Name: 5-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-oxo-3a,4,6,7-tetrahydro-2H-indazole-5-carbonitrile CAS Name: 5-(3-cyclopentyloxy-4-methoxyphenyl)-3-oxo-3a,4,6,7-tetrahydro-2H-indazole-5-carbonitrile IUPAC Name: 5-(3-cyclopentyloxy-4-methoxyphenyl)-3-oxo-3a,4,6,7-tetrahydro-2H-indazole-5-carbonitrile Traditional Name: 5-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-keto-3a,4,6,7-tetrahydro-2H-indazole-5-carbonitrile Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC3=NNC(=O)C3C2)C#N)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC3=NNC(=O)C3C2)C#N)OC4CCCC4

InChI

InChI=1S/C20H23N3O3/c1-25-17-7-6-13(10-18(17)26-14-4-2-3-5-14)20(12-21)9-8-16-15(11-20)19(24)23-22-16/h6-7,10,14-15H,2-5,8-9,11H2,1H3,(H,23,24)