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

Systemtic Name: (2S,3R)-4-azanylidene-7,7-dimethyl-2-(5-methylfuran-2-yl)-5-oxidanylidene-2,3,6,8-tetrahydrochromene-3-carbonitrile Openeye Name: (2S,3R)-4-imino-7,7-dimethyl-2-(5-methyl-2-furyl)-5-oxo-2,3,6,8-tetrahydrochromene-3-carbonitrile CAS Name: (2S,3R)-4-imino-7,7-dimethyl-2-(5-methyl-2-furanyl)-5-oxo-2,3,6,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (2S,3R)-4-imino-7,7-dimethyl-2-(5-methylfuran-2-yl)-5-oxo-2,3,6,8-tetrahydrochromene-3-carbonitrile Traditional Name: (2S,3R)-4-imino-5-keto-7,7-dimethyl-2-(5-methyl-2-furyl)-2,3,6,8-tetrahydrochromene-3-carbonitrile Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2C(C(=N)C3=C(O2)CC(CC3=O)(C)C)C#N

Isomeric SMILES

CC1=CC=C(O1)[C@@H]2[C@H](C(=N)C3=C(O2)CC(CC3=O)(C)C)C#N

InChI

InChI=1S/C17H18N2O3/c1-9-4-5-12(21-9)16-10(8-18)15(19)14-11(20)6-17(2,3)7-13(14)22-16/h4-5,10,16,19H,6-7H2,1-3H3/t10-,16-/m0/s1