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

Systemtic Name: 2-azanyl-4-(2-chloranyl-6-nitro-phenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(2-chloro-6-nitro-phenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(2-chloro-6-nitrophenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(2-chloro-6-nitrophenyl)-5-oxo-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(2-chloro-6-nitro-phenyl)-5-keto-7-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C22H16ClN3O4 MolecularWeight: 421.83314

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=C1OC(=C(C2C3=C(C=CC=C3Cl)[N+](=O)[O-])C#N)N)C4=CC=CC=C4

Isomeric SMILES

C1C(CC(=O)C2=C1OC(=C(C2C3=C(C=CC=C3Cl)[N+](=O)[O-])C#N)N)C4=CC=CC=C4

InChI

InChI=1S/C22H16ClN3O4/c23-15-7-4-8-16(26(28)29)20(15)19-14(11-24)22(25)30-18-10-13(9-17(27)21(18)19)12-5-2-1-3-6-12/h1-8,13,19H,9-10,25H2