ethyl 3-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)propanoate

Systemtic Name: ethyl 3-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)propanoate Openeye Name: ethyl 3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)propanoate CAS Name: 3-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)propanoate Traditional Name: 3-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-yl)propionic acid ethyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(N=CC=C2)SC3=CC=CC=C3C1=O

Isomeric SMILES

CCOC(=O)CCN1C2=C(N=CC=C2)SC3=CC=CC=C3C1=O

InChI

InChI=1S/C17H16N2O3S/c1-2-22-15(20)9-11-19-13-7-5-10-18-16(13)23-14-8-4-3-6-12(14)17(19)21/h3-8,10H,2,9,11H2,1H3