methyl 3-ethylbenzoate; sulfurochloridic acid

Systemtic Name: methyl 3-ethylbenzoate; sulfurochloridic acid Openeye Name: methyl 3-ethylbenzoate; sulfurochloridic acid CAS Name: 3-ethylbenzoic acid methyl ester; sulfurochloridic acid IUPAC Name: methyl 3-ethylbenzoate; sulfurochloridic acid Traditional Name: 3-ethylbenzoic acid methyl ester; sulfurochloridic acid Formula: C10H13ClO5S MolecularWeight: 280.72522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C(=O)OC.OS(=O)(=O)Cl

Isomeric SMILES

CCC1=CC=CC(=C1)C(=O)OC.OS(=O)(=O)Cl

InChI

InChI=1S/C10H12O2.ClHO3S/c1-3-8-5-4-6-9(7-8)10(11)12-2;1-5(2,3)4/h4-7H,3H2,1-2H3;(H,2,3,4)