(phenylmethyl) 4-[3-[3-ethoxy-3-oxidanylidene-2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoyloxyamino]propoxy]propyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-[3-ethoxy-3-oxidanylidene-2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl)ethanoyloxyamino]propoxy]propyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-[3-ethoxy-3-oxo-2-[[2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]propoxy]propyl]piperidine-1-carboxylate CAS Name: 4-[3-[3-ethoxy-3-oxo-2-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)ethoxy]amino]propoxy]propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-[3-ethoxy-3-oxo-2-[[2-(4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]propoxy]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[3-ethoxy-3-keto-2-[[2-(4-keto-2,3-dihydro-1,5-benzothiazepin-5-yl)acetyl]oxyamino]propoxy]propyl]piperidine-1-carboxylic acid benzyl ester Formula: C32H41N3O8S MolecularWeight: 627.74824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(COCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)NOC(=O)CN3C(=O)CCSC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C(COCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)NOC(=O)CN3C(=O)CCSC4=CC=CC=C43

InChI

InChI=1S/C32H41N3O8S/c1-2-41-31(38)26(33-43-30(37)21-35-27-12-6-7-13-28(27)44-20-16-29(35)36)23-40-19-8-11-24-14-17-34(18-15-24)32(39)42-22-25-9-4-3-5-10-25/h3-7,9-10,12-13,24,26,33H,2,8,11,14-23H2,1H3