(2S)-4-azanylidene-2-(4-bromophenyl)-7,7-dimethyl-5-oxidanylidene-2,3,6,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: (2S)-4-azanylidene-2-(4-bromophenyl)-7,7-dimethyl-5-oxidanylidene-2,3,6,8-tetrahydrochromene-3-carbonitrile Openeye Name: (2S)-2-(4-bromophenyl)-4-imino-7,7-dimethyl-5-oxo-2,3,6,8-tetrahydrochromene-3-carbonitrile CAS Name: (2S)-2-(4-bromophenyl)-4-imino-7,7-dimethyl-5-oxo-2,3,6,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (2S)-2-(4-bromophenyl)-4-imino-7,7-dimethyl-5-oxo-2,3,6,8-tetrahydrochromene-3-carbonitrile Traditional Name: (2S)-2-(4-bromophenyl)-4-imino-5-keto-7,7-dimethyl-2,3,6,8-tetrahydrochromene-3-carbonitrile Formula: C18H17BrN2O2 MolecularWeight: 373.24378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=N)C(C(O2)C3=CC=C(C=C3)Br)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=N)C([C@H](O2)C3=CC=C(C=C3)Br)C#N)C

InChI

InChI=1S/C18H17BrN2O2/c1-18(2)7-13(22)15-14(8-18)23-17(12(9-20)16(15)21)10-3-5-11(19)6-4-10/h3-6,12,17,21H,7-8H2,1-2H3/t12?,17-/m1/s1