(3S,9S,9aS)-3'-methyl-3-[(2S)-4-methyl-5-oxidanylidene-2H-furan-2-yl]spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-furan]-2'-one

Systemtic Name: (3S,9S,9aS)-3'-methyl-3-[(2S)-4-methyl-5-oxidanylidene-2H-furan-2-yl]spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-furan]-2'-one Openeye Name: (3S,9S,9aS)-3'-methyl-3-[(2S)-4-methyl-5-oxo-2H-furan-2-yl]spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-furan]-2'-one CAS Name: (3S,9S,9aS)-3'-methyl-3-[(2S)-4-methyl-5-oxo-2H-furan-2-yl]-2'-spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-furan]one IUPAC Name: (3S,9S,9aS)-3'-methyl-3-[(2S)-4-methyl-5-oxo-2H-furan-2-yl]spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-furan]-2'-one Traditional Name: (3S,9S,9aS)-3-[(2S)-5-keto-4-methyl-2H-furan-2-yl]-3'-methyl-spiro[1,2,3,5,6,7,8,9a-octahydropyrrol[1,2-a]azepine-9,5'-furan]-2'-one Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(OC1=O)C2CCC3N2CCCCC34C=C(C(=O)O4)C

Isomeric SMILES

CC1=C[C@H](OC1=O)[C@@H]2CC[C@@H]3N2CCCC[C@]34C=C(C(=O)O4)C

InChI

InChI=1S/C18H23NO4/c1-11-9-14(22-16(11)20)13-5-6-15-18(7-3-4-8-19(13)15)10-12(2)17(21)23-18/h9-10,13-15H,3-8H2,1-2H3/t13-,14-,15-,18-/m0/s1