1,3-benzodioxol-5-yl 3-phenothiazin-10-ylpropanoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-phenothiazin-10-ylpropanoate Openeye Name: 1,3-benzodioxol-5-yl 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid 1,3-benzodioxol-5-yl ester Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C22H17NO4S/c24-22(27-15-9-10-18-19(13-15)26-14-25-18)11-12-23-16-5-1-3-7-20(16)28-21-8-4-2-6-17(21)23/h1-10,13H,11-12,14H2