N-[(3S)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(3S)-6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-1H-pyrrole-2-carboxamide CAS Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: N-[(3S)-6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl]-1H-pyrrole-2-carboxamide Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)C3=CC=CN3)O)C

Isomeric SMILES

CC1([C@H](C(C2=C(O1)C=CC(=C2)C#N)NC(=O)C3=CC=CN3)O)C

InChI

InChI=1S/C17H17N3O3/c1-17(2)15(21)14(20-16(22)12-4-3-7-19-12)11-8-10(9-18)5-6-13(11)23-17/h3-8,14-15,19,21H,1-2H3,(H,20,22)/t14?,15-/m0/s1