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

Systemtic Name: (2S)-4-azanylidene-7,7-dimethyl-5-oxidanylidene-2-pyridin-4-yl-2,3,6,8-tetrahydrochromene-3-carbonitrile Openeye Name: (2S)-4-imino-7,7-dimethyl-5-oxo-2-(4-pyridyl)-2,3,6,8-tetrahydrochromene-3-carbonitrile CAS Name: (2S)-4-imino-7,7-dimethyl-5-oxo-2-pyridin-4-yl-2,3,6,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (2S)-4-imino-7,7-dimethyl-5-oxo-2-pyridin-4-yl-2,3,6,8-tetrahydrochromene-3-carbonitrile Traditional Name: (2S)-4-imino-5-keto-7,7-dimethyl-2-(4-pyridyl)-2,3,6,8-tetrahydrochromene-3-carbonitrile Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O2/c1-17(2)7-12(21)14-13(8-17)22-16(11(9-18)15(14)19)10-3-5-20-6-4-10/h3-6,11,16,19H,7-8H2,1-2H3/t11?,16-/m1/s1