N'-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-N'-ethanoyl-ethanehydrazide

Systemtic Name: N'-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-N'-ethanoyl-ethanehydrazide Openeye Name: N'-acetyl-N'-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]acetohydrazide CAS Name: N'-acetyl-N'-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]acetohydrazide IUPAC Name: N'-acetyl-N'-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]acetohydrazide Traditional Name: N'-acetyl-N'-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]acetohydrazide Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN(C1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O)C(=O)C

Isomeric SMILES

CC(=O)NN([C@H]1[C@@H](C(OC2=C1C=C(C=C2)C#N)(C)C)O)C(=O)C

InChI

InChI=1S/C16H19N3O4/c1-9(20)18-19(10(2)21)14-12-7-11(8-17)5-6-13(12)23-16(3,4)15(14)22/h5-7,14-15,22H,1-4H3,(H,18,20)/t14-,15+/m1/s1