2,2-dimethyl-4-[methyl-(3-oxidanylidenecyclopenten-1-yl)amino]-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-4-[methyl-(3-oxidanylidenecyclopenten-1-yl)amino]-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-4-[methyl-(3-oxocyclopenten-1-yl)amino]chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-[methyl-(3-oxo-1-cyclopentenyl)amino]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-[methyl-(3-oxocyclopenten-1-yl)amino]-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-[(3-ketocyclopenten-1-yl)-methyl-amino]-2,2-dimethyl-chroman-6-carbonitrile Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(C)C3=CC(=O)CC3)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(C)C3=CC(=O)CC3)O)C

InChI

InChI=1S/C18H20N2O3/c1-18(2)17(22)16(20(3)12-5-6-13(21)9-12)14-8-11(10-19)4-7-15(14)23-18/h4,7-9,16-17,22H,5-6H2,1-3H3