ethyl 2-[5-(2-azanyloxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-2-yl]-4-phenyl-butanoate

Systemtic Name: ethyl 2-[5-(2-azanyloxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-2-yl]-4-phenyl-butanoate Openeye Name: ethyl 2-[5-(2-aminooxy-2-oxo-ethyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-2-yl]-4-phenyl-butanoate CAS Name: 2-[5-(2-aminooxy-2-oxoethyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-2-yl]-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[5-(2-aminooxy-2-oxoethyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-2-yl]-4-phenylbutanoate Traditional Name: 2-[5-(2-aminooxy-2-keto-ethyl)-4-keto-2,3-dihydro-1,5-benzothiazepin-2-yl]-4-phenyl-butyric acid ethyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)C2CC(=O)N(C3=CC=CC=C3S2)CC(=O)ON

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)C2CC(=O)N(C3=CC=CC=C3S2)CC(=O)ON

InChI

InChI=1S/C23H26N2O5S/c1-2-29-23(28)17(13-12-16-8-4-3-5-9-16)20-14-21(26)25(15-22(27)30-24)18-10-6-7-11-19(18)31-20/h3-11,17,20H,2,12-15,24H2,1H3