ethyl 10-azanyl-2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoyloxyamino]decanoate

Systemtic Name: ethyl 10-azanyl-2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoyloxyamino]decanoate Openeye Name: ethyl 10-amino-2-[[2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]decanoate CAS Name: 10-amino-2-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)ethoxy]amino]decanoic acid ethyl ester IUPAC Name: ethyl 10-amino-2-[[2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]decanoate Traditional Name: 10-amino-2-[[2-(4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]capric acid ethyl ester Formula: C23H35N3O5S MolecularWeight: 465.6061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCCCCN)NOC(=O)CN1C(=O)CCSC2=CC=CC=C21

Isomeric SMILES

CCOC(=O)C(CCCCCCCCN)NOC(=O)CN1C(=O)CCSC2=CC=CC=C21

InChI

InChI=1S/C23H35N3O5S/c1-2-30-23(29)18(11-7-5-3-4-6-10-15-24)25-31-22(28)17-26-19-12-8-9-13-20(19)32-16-14-21(26)27/h8-9,12-13,18,25H,2-7,10-11,14-17,24H2,1H3