4-(2-methyl-5-nitro-phenyl)sulfonyloxybenzoic acid

Systemtic Name: 4-(2-methyl-5-nitro-phenyl)sulfonyloxybenzoic acid Openeye Name: 4-(2-methyl-5-nitro-phenyl)sulfonyloxybenzoic acid CAS Name: 4-(2-methyl-5-nitrophenyl)sulfonyloxybenzoic acid IUPAC Name: 4-(2-methyl-5-nitrophenyl)sulfonyloxybenzoic acid Traditional Name: 4-(2-methyl-5-nitro-phenyl)sulfonyloxybenzoic acid Formula: C14H11NO7S MolecularWeight: 337.30464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H11NO7S/c1-9-2-5-11(15(18)19)8-13(9)23(20,21)22-12-6-3-10(4-7-12)14(16)17/h2-8H,1H3,(H,16,17)