[2-methoxy-6-(4-methoxyphenyl)pyrrolo[2,1-d][1,5]benzothiazepin-7-yl] ethanoate

Systemtic Name: [2-methoxy-6-(4-methoxyphenyl)pyrrolo[2,1-d][1,5]benzothiazepin-7-yl] ethanoate Openeye Name: [2-methoxy-6-(4-methoxyphenyl)pyrrolo[2,1-d][1,5]benzothiazepin-7-yl] acetate CAS Name: acetic acid [2-methoxy-6-(4-methoxyphenyl)-7-pyrrolo[2,1-d][1,5]benzothiazepinyl] ester IUPAC Name: [2-methoxy-6-(4-methoxyphenyl)pyrrolo[2,1-d][1,5]benzothiazepin-7-yl] acetate Traditional Name: acetic acid [2-methoxy-6-(4-methoxyphenyl)pyrrolo[2,1-d][1,5]benzothiazepin-7-yl] ester Formula: C22H19NO4S MolecularWeight: 393.45556

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(SC2=C(C=C(C=C2)OC)N3C1=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)OC1=C(SC2=C(C=C(C=C2)OC)N3C1=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H19NO4S/c1-14(24)27-21-18-5-4-12-23(18)19-13-17(26-3)10-11-20(19)28-22(21)15-6-8-16(25-2)9-7-15/h4-13H,1-3H3