N-[(3S)-6-cyano-2,2-dimethyl-3-oxidanyl-5-pyrrolidin-1-yl-3,4-dihydrochromen-7-yl]ethanamide

Systemtic Name: N-[(3S)-6-cyano-2,2-dimethyl-3-oxidanyl-5-pyrrolidin-1-yl-3,4-dihydrochromen-7-yl]ethanamide Openeye Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-5-pyrrolidin-1-yl-chroman-7-yl]acetamide CAS Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-5-(1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-7-yl]acetamide IUPAC Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-5-pyrrolidin-1-yl-3,4-dihydrochromen-7-yl]acetamide Traditional Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-5-pyrrolidino-chroman-7-yl]acetamide Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(CC(C(O2)(C)C)O)C(=C1C#N)N3CCCC3

Isomeric SMILES

CC(=O)NC1=CC2=C(C[C@@H](C(O2)(C)C)O)C(=C1C#N)N3CCCC3

InChI

InChI=1S/C18H23N3O3/c1-11(22)20-14-9-15-12(8-16(23)18(2,3)24-15)17(13(14)10-19)21-6-4-5-7-21/h9,16,23H,4-8H2,1-3H3,(H,20,22)/t16-/m0/s1