2-azanyl-4-[4-(2-chloranyl-4-nitro-phenoxy)phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-(2-chloranyl-4-nitro-phenoxy)phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-[4-(2-chloro-4-nitro-phenoxy)phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-[4-(2-chloro-4-nitrophenoxy)phenyl]-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[4-(2-chloro-4-nitrophenoxy)phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-[4-(2-chloro-4-nitro-phenoxy)phenyl]-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C22H16ClN3O5 MolecularWeight: 437.83254

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)OC4=C(C=C(C=C4)[N+](=O)[O-])Cl)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)OC4=C(C=C(C=C4)[N+](=O)[O-])Cl)C(=O)C1

InChI

InChI=1S/C22H16ClN3O5/c23-16-10-13(26(28)29)6-9-18(16)30-14-7-4-12(5-8-14)20-15(11-24)22(25)31-19-3-1-2-17(27)21(19)20/h4-10,20H,1-3,25H2