4-[[1-(2-dimethylaminoethyl)-6-oxidanylidene-pyridazin-3-yl]amino]-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[[1-(2-dimethylaminoethyl)-6-oxidanylidene-pyridazin-3-yl]amino]-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[[1-(2-dimethylaminoethyl)-6-oxo-pyridazin-3-yl]amino]-3-hydroxy-2,2-bis(methoxymethyl)chromane-6-carbonitrile CAS Name: 4-[[1-(2-dimethylaminoethyl)-6-oxo-3-pyridazinyl]amino]-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[[1-(2-dimethylaminoethyl)-6-oxopyridazin-3-yl]amino]-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[[1-(2-dimethylaminoethyl)-6-keto-pyridazin-3-yl]amino]-3-hydroxy-2,2-bis(methoxymethyl)chroman-6-carbonitrile Formula: C22H29N5O5 MolecularWeight: 443.49616

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)C=CC(=N1)NC2C(C(OC3=C2C=C(C=C3)C#N)(COC)COC)O

Isomeric SMILES

CN(C)CCN1C(=O)C=CC(=N1)NC2C(C(OC3=C2C=C(C=C3)C#N)(COC)COC)O

InChI

InChI=1S/C22H29N5O5/c1-26(2)9-10-27-19(28)8-7-18(25-27)24-20-16-11-15(12-23)5-6-17(16)32-22(13-30-3,14-31-4)21(20)29/h5-8,11,20-21,29H,9-10,13-14H2,1-4H3,(H,24,25)