2-(cyclopentylmethyl)-5,6-bis(4-methoxyphenyl)-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-(cyclopentylmethyl)-5,6-bis(4-methoxyphenyl)-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-(cyclopentylmethyl)-5,6-bis(4-methoxyphenyl)-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-(cyclopentylmethyl)-5,6-bis(4-methoxyphenyl)-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-(cyclopentylmethyl)-5,6-bis(4-methoxyphenyl)-3-oxopyridazine-4-carbonitrile Traditional Name: 2-(cyclopentylmethyl)-3-keto-5,6-bis(4-methoxyphenyl)pyridazine-4-carbonitrile Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=C(C=C3)OC)CC4CCCC4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=C(C=C3)OC)CC4CCCC4)C#N

InChI

InChI=1S/C25H25N3O3/c1-30-20-11-7-18(8-12-20)23-22(15-26)25(29)28(16-17-5-3-4-6-17)27-24(23)19-9-13-21(31-2)14-10-19/h7-14,17H,3-6,16H2,1-2H3