ethyl (3S)-3-[(1S)-2-chloranyl-1-methoxy-ethyl]-2-oxidanylidene-cyclododecane-1-carboxylate

Systemtic Name: ethyl (3S)-3-[(1S)-2-chloranyl-1-methoxy-ethyl]-2-oxidanylidene-cyclododecane-1-carboxylate Openeye Name: ethyl (3S)-3-[(1S)-2-chloro-1-methoxy-ethyl]-2-oxo-cyclododecanecarboxylate CAS Name: (3S)-3-[(1S)-2-chloro-1-methoxyethyl]-2-oxo-1-cyclododecanecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-3-[(1S)-2-chloro-1-methoxyethyl]-2-oxocyclododecane-1-carboxylate Traditional Name: (3S)-3-[(1S)-2-chloro-1-methoxy-ethyl]-2-keto-cyclododecanecarboxylic acid ethyl ester Formula: C18H31ClO4 MolecularWeight: 346.88934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCCCCCCC(C1=O)C(CCl)OC

Isomeric SMILES

CCOC(=O)C1CCCCCCCCC[C@H](C1=O)[C@@H](CCl)OC

InChI

InChI=1S/C18H31ClO4/c1-3-23-18(21)15-12-10-8-6-4-5-7-9-11-14(17(15)20)16(13-19)22-2/h14-16H,3-13H2,1-2H3/t14-,15?,16+/m0/s1