13-(ethanoylsulfanylmethyl)-14-oxidanylidene-1-azacyclotetradecane-2-carboxylic acid

Systemtic Name: 13-(ethanoylsulfanylmethyl)-14-oxidanylidene-1-azacyclotetradecane-2-carboxylic acid Openeye Name: 13-(acetylsulfanylmethyl)-14-oxo-azacyclotetradecane-2-carboxylic acid CAS Name: 13-[(acetylthio)methyl]-14-oxo-azacyclotetradecane-2-carboxylic acid IUPAC Name: 13-(acetylsulfanylmethyl)-14-oxo-azacyclotetradecane-2-carboxylic acid Traditional Name: 13-[(acetylthio)methyl]-14-keto-azacyclotetradecane-2-carboxylic acid Formula: C17H29NO4S MolecularWeight: 343.48146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1CCCCCCCCCCC(NC1=O)C(=O)O

Isomeric SMILES

CC(=O)SCC1CCCCCCCCCCC(NC1=O)C(=O)O

InChI

InChI=1S/C17H29NO4S/c1-13(19)23-12-14-10-8-6-4-2-3-5-7-9-11-15(17(21)22)18-16(14)20/h14-15H,2-12H2,1H3,(H,18,20)(H,21,22)