ethyl 2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoyloxyamino]-6-piperidin-1-yl-hexanoate

Systemtic Name: ethyl 2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoyloxyamino]-6-piperidin-1-yl-hexanoate Openeye Name: ethyl 2-[[2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]-6-(1-piperidyl)hexanoate CAS Name: 2-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)ethoxy]amino]-6-(1-piperidinyl)hexanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]-6-piperidin-1-ylhexanoate Traditional Name: 2-[[2-(4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]-6-piperidino-hexanoic acid ethyl ester Formula: C24H35N3O5S MolecularWeight: 477.6168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCN1CCCCC1)NOC(=O)CN2C(=O)CCSC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C(CCCCN1CCCCC1)NOC(=O)CN2C(=O)CCSC3=CC=CC=C32

InChI

InChI=1S/C24H35N3O5S/c1-2-31-24(30)19(10-6-9-16-26-14-7-3-8-15-26)25-32-23(29)18-27-20-11-4-5-12-21(20)33-17-13-22(27)28/h4-5,11-12,19,25H,2-3,6-10,13-18H2,1H3