[8-chloranyl-2-(4-methoxyphenyl)-4-oxidanylidene-3,5-dihydro-1,2-benzothiazepin-3-yl] ethanoate

Systemtic Name: [8-chloranyl-2-(4-methoxyphenyl)-4-oxidanylidene-3,5-dihydro-1,2-benzothiazepin-3-yl] ethanoate Openeye Name: [8-chloro-2-(4-methoxyphenyl)-4-oxo-3,5-dihydro-1,2-benzothiazepin-3-yl] acetate CAS Name: acetic acid [8-chloro-2-(4-methoxyphenyl)-4-oxo-3,5-dihydro-1,2-benzothiazepin-3-yl] ester IUPAC Name: [8-chloro-2-(4-methoxyphenyl)-4-oxo-3,5-dihydro-1,2-benzothiazepin-3-yl] acetate Traditional Name: acetic acid [8-chloro-4-keto-2-(4-methoxyphenyl)-3,5-dihydro-1,2-benzothiazepin-3-yl] ester Formula: C18H16ClNO4S MolecularWeight: 377.84194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(=O)CC2=C(C=C(C=C2)Cl)SN1C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)OC1C(=O)CC2=C(C=C(C=C2)Cl)SN1C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H16ClNO4S/c1-11(21)24-18-16(22)9-12-3-4-13(19)10-17(12)25-20(18)14-5-7-15(23-2)8-6-14/h3-8,10,18H,9H2,1-2H3