2-[(9-nitroso-8-oxidanyl-dibenzothiophen-2-yl)oxycarbonylamino]ethyl 2-methylprop-2-enoate

Systemtic Name: 2-[(9-nitroso-8-oxidanyl-dibenzothiophen-2-yl)oxycarbonylamino]ethyl 2-methylprop-2-enoate Openeye Name: 2-[(8-hydroxy-9-nitroso-dibenzothiophen-2-yl)oxycarbonylamino]ethyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 2-[[(8-hydroxy-9-nitroso-2-dibenzothiophenyl)oxy-oxomethyl]amino]ethyl ester IUPAC Name: 2-[(8-hydroxy-9-nitrosodibenzothiophen-2-yl)oxycarbonylamino]ethyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 2-[(8-hydroxy-9-nitroso-dibenzothiophen-2-yl)oxycarbonylamino]ethyl ester Formula: C19H16N2O6S MolecularWeight: 400.40514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OCCNC(=O)OC1=CC2=C(C=C1)SC3=C2C(=C(C=C3)O)N=O

Isomeric SMILES

CC(=C)C(=O)OCCNC(=O)OC1=CC2=C(C=C1)SC3=C2C(=C(C=C3)O)N=O

InChI

InChI=1S/C19H16N2O6S/c1-10(2)18(23)26-8-7-20-19(24)27-11-3-5-14-12(9-11)16-15(28-14)6-4-13(22)17(16)21-25/h3-6,9,22H,1,7-8H2,2H3,(H,20,24)