methyl 2-isocyanatosulfonyl-5-phenoxy-benzoate

Systemtic Name: methyl 2-isocyanatosulfonyl-5-phenoxy-benzoate Openeye Name: methyl 2-isocyanatosulfonyl-5-phenoxy-benzoate CAS Name: 2-isocyanatosulfonyl-5-phenoxybenzoic acid methyl ester IUPAC Name: methyl 2-isocyanatosulfonyl-5-phenoxybenzoate Traditional Name: 2-isocyanatosulfonyl-5-phenoxy-benzoic acid methyl ester Formula: C15H11NO6S MolecularWeight: 333.31594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)OC2=CC=CC=C2)S(=O)(=O)N=C=O

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)OC2=CC=CC=C2)S(=O)(=O)N=C=O

InChI

InChI=1S/C15H11NO6S/c1-21-15(18)13-9-12(22-11-5-3-2-4-6-11)7-8-14(13)23(19,20)16-10-17/h2-9H,1H3