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

Systemtic Name: 2-azanyl-4-(2-chloranyl-4-methoxy-3-oxidanyl-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(2-chloro-3-hydroxy-4-methoxy-phenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(2-chloro-3-hydroxy-4-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(2-chloro-3-hydroxy-4-methoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(2-chloro-3-hydroxy-4-methoxy-phenyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C17H15ClN2O4 MolecularWeight: 346.765

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)Cl)O

Isomeric SMILES

COC1=C(C(=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)Cl)O

InChI

InChI=1S/C17H15ClN2O4/c1-23-12-6-5-8(15(18)16(12)22)13-9(7-19)17(20)24-11-4-2-3-10(21)14(11)13/h5-6,13,22H,2-4,20H2,1H3