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

Systemtic Name: 2-azanyl-4-(4-bromophenyl)-7-methyl-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(4-bromophenyl)-7-methyl-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(4-bromophenyl)-7-methyl-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromophenyl)-7-methyl-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(4-bromophenyl)-5-keto-7-methyl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C17H15BrN2O2 MolecularWeight: 359.2172

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)Br)C(=O)C1

Isomeric SMILES

CC1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)Br)C(=O)C1

InChI

InChI=1S/C17H15BrN2O2/c1-9-6-13(21)16-14(7-9)22-17(20)12(8-19)15(16)10-2-4-11(18)5-3-10/h2-5,9,15H,6-7,20H2,1H3