2-azanyl-7-(3,4-dimethoxyphenyl)-4-(4-nitrophenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-7-(3,4-dimethoxyphenyl)-4-(4-nitrophenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-7-(3,4-dimethoxyphenyl)-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-7-(3,4-dimethoxyphenyl)-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-7-(3,4-dimethoxyphenyl)-4-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-7-(3,4-dimethoxyphenyl)-5-keto-4-(4-nitrophenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C24H21N3O6 MolecularWeight: 447.44004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC3=C(C(C(=C(O3)N)C#N)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC3=C(C(C(=C(O3)N)C#N)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)C2)OC

InChI

InChI=1S/C24H21N3O6/c1-31-19-8-5-14(10-20(19)32-2)15-9-18(28)23-21(11-15)33-24(26)17(12-25)22(23)13-3-6-16(7-4-13)27(29)30/h3-8,10,15,22H,9,11,26H2,1-2H3