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

Systemtic Name: 4-[(1-heptyl-6-oxidanylidene-pyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[(1-heptyl-6-oxo-pyridazin-3-yl)amino]-3-hydroxy-2,2-bis(methoxymethyl)chromane-6-carbonitrile CAS Name: 4-[(1-heptyl-6-oxo-3-pyridazinyl)amino]-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[(1-heptyl-6-oxopyridazin-3-yl)amino]-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[(1-heptyl-6-keto-pyridazin-3-yl)amino]-3-hydroxy-2,2-bis(methoxymethyl)chroman-6-carbonitrile Formula: C25H34N4O5 MolecularWeight: 470.56126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)C=CC(=N1)NC2C(C(OC3=C2C=C(C=C3)C#N)(COC)COC)O

Isomeric SMILES

CCCCCCCN1C(=O)C=CC(=N1)NC2C(C(OC3=C2C=C(C=C3)C#N)(COC)COC)O

InChI

InChI=1S/C25H34N4O5/c1-4-5-6-7-8-13-29-22(30)12-11-21(28-29)27-23-19-14-18(15-26)9-10-20(19)34-25(16-32-2,17-33-3)24(23)31/h9-12,14,23-24,31H,4-8,13,16-17H2,1-3H3,(H,27,28)