methyl (3S)-2-methyl-5,12-bis(oxidanylidene)-1-oxa-4-azacyclododec-8-ene-3-carboxylate

Systemtic Name: methyl (3S)-2-methyl-5,12-bis(oxidanylidene)-1-oxa-4-azacyclododec-8-ene-3-carboxylate Openeye Name: methyl (3S)-2-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-3-carboxylate CAS Name: (3S)-2-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-3-carboxylic acid methyl ester IUPAC Name: methyl (3S)-2-methyl-5,12-dioxo-1-oxa-4-azacyclododec-8-ene-3-carboxylate Traditional Name: (3S)-5,12-diketo-2-methyl-1-oxa-4-azacyclododec-8-ene-3-carboxylic acid methyl ester Formula: C13H19NO5 MolecularWeight: 269.29366

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(NC(=O)CCC=CCCC(=O)O1)C(=O)OC

Isomeric SMILES

CC1[C@H](NC(=O)CCC=CCCC(=O)O1)C(=O)OC

InChI

InChI=1S/C13H19NO5/c1-9-12(13(17)18-2)14-10(15)7-5-3-4-6-8-11(16)19-9/h3-4,9,12H,5-8H2,1-2H3,(H,14,15)/t9?,12-/m0/s1