[(3R,4S)-6-ethanoyl-2,2-dimethyl-4-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromen-3-yl] (E)-2-methylbut-2-enoate

Systemtic Name: [(3R,4S)-6-ethanoyl-2,2-dimethyl-4-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromen-3-yl] (E)-2-methylbut-2-enoate Openeye Name: [(3R,4S)-6-acetyl-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)chroman-3-yl] (E)-2-methylbut-2-enoate CAS Name: (E)-2-methyl-2-butenoic acid [(3R,4S)-6-acetyl-2,2-dimethyl-4-(2-oxo-1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [(3R,4S)-6-acetyl-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-3,4-dihydrochromen-3-yl] (E)-2-methylbut-2-enoate Traditional Name: (E)-2-methylbut-2-enoic acid [(3R,4S)-6-acetyl-4-(2-ketopyrrolidino)-2,2-dimethyl-chroman-3-yl] ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)OC1C(C2=C(C=CC(=C2)C(=O)C)OC1(C)C)N3CCCC3=O

Isomeric SMILES

C/C=C(\C)/C(=O)O[C@@H]1[C@H](C2=C(C=CC(=C2)C(=O)C)OC1(C)C)N3CCCC3=O

InChI

InChI=1S/C22H27NO5/c1-6-13(2)21(26)27-20-19(23-11-7-8-18(23)25)16-12-15(14(3)24)9-10-17(16)28-22(20,4)5/h6,9-10,12,19-20H,7-8,11H2,1-5H3/b13-6+/t19-,20+/m0/s1