N-[1-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-ylidene]pyridine-4-carboxamide

Systemtic Name: N-[1-[(3S,4R)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-ylidene]pyridine-4-carboxamide Openeye Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]pyrrolidin-2-ylidene]pyridine-4-carboxamide CAS Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pyrrolidinylidene]-4-pyridinecarboxamide IUPAC Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]pyrrolidin-2-ylidene]pyridine-4-carboxamide Traditional Name: N-[1-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]pyrrolidin-2-ylidene]isonicotinamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CCCC3=NC(=O)C4=CC=NC=C4)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C#N)N3CCCC3=NC(=O)C4=CC=NC=C4)O)C

InChI

InChI=1S/C22H22N4O3/c1-22(2)20(27)19(16-12-14(13-23)5-6-17(16)29-22)26-11-3-4-18(26)25-21(28)15-7-9-24-10-8-15/h5-10,12,19-20,27H,3-4,11H2,1-2H3/t19-,20+/m1/s1