N-[(3S,4R)-6-cyano-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromen-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[(3S,4R)-6-cyano-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromen-4-yl]pyridine-3-carboxamide Openeye Name: N-[(3S,4R)-6-cyano-3-hydroxy-2,2-bis(methoxymethyl)chroman-4-yl]pyridine-3-carboxamide CAS Name: N-[(3S,4R)-6-cyano-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydro-2H-1-benzopyran-4-yl]-3-pyridinecarboxamide IUPAC Name: N-[(3S,4R)-6-cyano-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydrochromen-4-yl]pyridine-3-carboxamide Traditional Name: N-[(3S,4R)-6-cyano-3-hydroxy-2,2-bis(methoxymethyl)chroman-4-yl]nicotinamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)C3=CN=CC=C3)O)COC

Isomeric SMILES

COCC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C#N)NC(=O)C3=CN=CC=C3)O)COC

InChI

InChI=1S/C20H21N3O5/c1-26-11-20(12-27-2)18(24)17(23-19(25)14-4-3-7-22-10-14)15-8-13(9-21)5-6-16(15)28-20/h3-8,10,17-18,24H,11-12H2,1-2H3,(H,23,25)/t17-,18+/m1/s1