(3R,4S)-2,2-dimethyl-3-oxidanyl-4-[(5-oxidanylidene-2H-furan-3-yl)amino]-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3R,4S)-2,2-dimethyl-3-oxidanyl-4-[(5-oxidanylidene-2H-furan-3-yl)amino]-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3R,4S)-3-hydroxy-2,2-dimethyl-4-[(5-oxo-2H-furan-3-yl)amino]chromane-6-carbonitrile CAS Name: (3R,4S)-3-hydroxy-2,2-dimethyl-4-[(5-oxo-2H-furan-3-yl)amino]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3R,4S)-3-hydroxy-2,2-dimethyl-4-[(5-oxo-2H-furan-3-yl)amino]-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3R,4S)-3-hydroxy-4-[(5-keto-2H-furan-3-yl)amino]-2,2-dimethyl-chroman-6-carbonitrile Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CC(=O)OC3)O)C

Isomeric SMILES

CC1([C@@H]([C@H](C2=C(O1)C=CC(=C2)C#N)NC3=CC(=O)OC3)O)C

InChI

InChI=1S/C16H16N2O4/c1-16(2)15(20)14(18-10-6-13(19)21-8-10)11-5-9(7-17)3-4-12(11)22-16/h3-6,14-15,18,20H,8H2,1-2H3/t14-,15+/m0/s1