2,2-dimethyl-4-(3-octoxy-5-oxidanylidene-2H-pyrrol-1-yl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-4-(3-octoxy-5-oxidanylidene-2H-pyrrol-1-yl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-4-(3-octoxy-5-oxo-2H-pyrrol-1-yl)chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-(3-octoxy-5-oxo-2H-pyrrol-1-yl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-(3-octoxy-5-oxo-2H-pyrrol-1-yl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(2-keto-4-octoxy-3-pyrrolin-1-yl)-2,2-dimethyl-chroman-6-carbonitrile Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)O

Isomeric SMILES

CCCCCCCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)C#N)(C)C)O

InChI

InChI=1S/C24H32N2O4/c1-4-5-6-7-8-9-12-29-18-14-21(27)26(16-18)22-19-13-17(15-25)10-11-20(19)30-24(2,3)23(22)28/h10-11,13-14,22-23,28H,4-9,12,16H2,1-3H3