ethyl 3-(6-pentanoylimino-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-yl)propanoate

Systemtic Name: ethyl 3-(6-pentanoylimino-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-yl)propanoate Openeye Name: ethyl 3-(6-pentanoylimino-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-yl)propanoate CAS Name: 3-[6-(1-oxopentylimino)-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(6-pentanoylimino-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-yl)propanoate Traditional Name: 3-(6-valerylimino-[1,3]dioxolo[4,5-f][1,3]benzothiazol-7-yl)propionic acid ethyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=CC3=C(C=C2S1)OCO3)CCC(=O)OCC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=CC3=C(C=C2S1)OCO3)CCC(=O)OCC

InChI

InChI=1S/C18H22N2O5S/c1-3-5-6-16(21)19-18-20(8-7-17(22)23-4-2)12-9-13-14(25-11-24-13)10-15(12)26-18/h9-10H,3-8,11H2,1-2H3