(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(6-methoxy-1-benzofuran-3-yl)ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(6-methoxy-1-benzofuran-3-yl)ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-(6-methoxybenzofuran-3-yl)acetate CAS Name: 2-(6-methoxy-3-benzofuranyl)acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-(6-methoxy-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methoxybenzofuran-3-yl)acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C25H19NO5S MolecularWeight: 445.48706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C25H19NO5S/c1-29-17-10-11-18-16(14-30-21(18)13-17)12-25(28)31-15-24(27)26-19-6-2-4-8-22(19)32-23-9-5-3-7-20(23)26/h2-11,13-14H,12,15H2,1H3