2-methoxyethanamine; 2-oxidanylbenzoate; 8-thiabicyclo[2.2.2]octa-1,3,5-triene

Systemtic Name: 2-methoxyethanamine; 2-oxidanylbenzoate; 8-thiabicyclo[2.2.2]octa-1,3,5-triene Openeye Name: 2-hydroxybenzoate; 2-methoxyethanamine; 8-thiabicyclo[2.2.2]octa-1,3,5-triene CAS Name: 2-hydroxybenzoate; 2-methoxyethanamine; 8-thiabicyclo[2.2.2]octa-1,3,5-triene IUPAC Name: 2-hydroxybenzoate; 2-methoxyethanamine; 8-thiabicyclo[2.2.2]octa-1,3,5-triene Traditional Name: 2-methoxyethylamine; salicylate; 8-thiabicyclo[2.2.2]octa-1,3,5-triene Formula: C17H20NO4S- MolecularWeight: 334.41

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Descriptors Computed from Structure

Canonical SMILES:

COCCN.C1C2=CC=C(S1)C=C2.C1=CC=C(C(=C1)C(=O)[O-])O

Isomeric SMILES

COCCN.C1C2=CC=C(S1)C=C2.C1=CC=C(C(=C1)C(=O)[O-])O

InChI

InChI=1S/C7H6O3.C7H6S.C3H9NO/c8-6-4-2-1-3-5(6)7(9)10;1-3-7-4-2-6(1)5-8-7;1-5-3-2-4/h1-4,8H,(H,9,10);1-4H,5H2;2-4H2,1H3/p-1