4-[(2-chloranyl-3-oxidanylidene-cyclopenten-1-yl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[(2-chloranyl-3-oxidanylidene-cyclopenten-1-yl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[(2-chloro-3-oxo-cyclopenten-1-yl)amino]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 4-[(2-chloro-3-oxo-1-cyclopentenyl)amino]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[(2-chloro-3-oxocyclopenten-1-yl)amino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[(2-chloro-3-keto-cyclopenten-1-yl)amino]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C17H17ClN2O3 MolecularWeight: 332.78148

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=C(C(=O)CC3)Cl)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=C(C(=O)CC3)Cl)O)C

InChI

InChI=1S/C17H17ClN2O3/c1-17(2)16(22)15(20-11-4-5-12(21)14(11)18)10-7-9(8-19)3-6-13(10)23-17/h3,6-7,15-16,20,22H,4-5H2,1-2H3