ethyl 2-[6-(4-methylpiperazin-1-yl)sulfonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-(4-methylpiperazin-1-yl)sulfonyl-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-(4-methylpiperazin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetate CAS Name: 2-[6-[(4-methyl-1-piperazinyl)sulfonyl]-2-oxo-1,3-benzoxazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-(4-methylpiperazin-1-yl)sulfonyl-2-oxo-1,3-benzoxazol-3-yl]acetate Traditional Name: 2-[2-keto-6-(4-methylpiperazino)sulfonyl-1,3-benzoxazol-3-yl]acetic acid ethyl ester Formula: C16H21N3O6S MolecularWeight: 383.41944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)OC1=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)OC1=O

InChI

InChI=1S/C16H21N3O6S/c1-3-24-15(20)11-19-13-5-4-12(10-14(13)25-16(19)21)26(22,23)18-8-6-17(2)7-9-18/h4-5,10H,3,6-9,11H2,1-2H3