2-azanyl-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(4-hydroxy-3,5-dimethoxy-phenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(4-hydroxy-3,5-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(4-hydroxy-3,5-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(4-hydroxy-3,5-dimethoxy-phenyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C2C(=C(OC3=C2C(=O)CCC3)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C2C(=C(OC3=C2C(=O)CCC3)N)C#N

InChI

InChI=1S/C18H18N2O5/c1-23-13-6-9(7-14(24-2)17(13)22)15-10(8-19)18(20)25-12-5-3-4-11(21)16(12)15/h6-7,15,22H,3-5,20H2,1-2H3