7-(4-bromophenyl)-2-methyl-5-oxidanylidene-4-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile hydrochloride

Systemtic Name: 7-(4-bromophenyl)-2-methyl-5-oxidanylidene-4-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile hydrochloride Openeye Name: 7-(4-bromophenyl)-2-methyl-5-oxo-4-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile hydrochloride CAS Name: 7-(4-bromophenyl)-2-methyl-5-oxo-4-phenyl-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile hydrochloride IUPAC Name: 7-(4-bromophenyl)-2-methyl-5-oxo-4-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile hydrochloride Traditional Name: 7-(4-bromophenyl)-5-keto-2-methyl-4-phenyl-4,6,7,8-tetrahydrochromene-3-carbonitrile hydrochloride Formula: C23H19BrClNO2 MolecularWeight: 456.75946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(O1)CC(CC2=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N.Cl

Isomeric SMILES

CC1=C(C(C2=C(O1)CC(CC2=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N.Cl

InChI

InChI=1S/C23H18BrNO2.ClH/c1-14-19(13-25)22(16-5-3-2-4-6-16)23-20(26)11-17(12-21(23)27-14)15-7-9-18(24)10-8-15;/h2-10,17,22H,11-12H2,1H3;1H