methyl 4-ethoxy-2-isocyanatosulfonyl-benzoate

Systemtic Name: methyl 4-ethoxy-2-isocyanatosulfonyl-benzoate Openeye Name: methyl 4-ethoxy-2-isocyanatosulfonyl-benzoate CAS Name: 4-ethoxy-2-isocyanatosulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-ethoxy-2-isocyanatosulfonylbenzoate Traditional Name: 4-ethoxy-2-isocyanatosulfonyl-benzoic acid methyl ester Formula: C11H11NO6S MolecularWeight: 285.27314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)N=C=O

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)N=C=O

InChI

InChI=1S/C11H11NO6S/c1-3-18-8-4-5-9(11(14)17-2)10(6-8)19(15,16)12-7-13/h4-6H,3H2,1-2H3