2-(5-nitronaphthalen-2-yl)sulfinylethanoic acid

Systemtic Name: 2-(5-nitronaphthalen-2-yl)sulfinylethanoic acid Openeye Name: 2-[(5-nitro-2-naphthyl)sulfinyl]acetic acid CAS Name: 2-[(5-nitro-2-naphthalenyl)sulfinyl]acetic acid IUPAC Name: 2-(5-nitronaphthalen-2-yl)sulfinylacetic acid Traditional Name: 2-[(5-nitro-2-naphthyl)sulfinyl]acetic acid Formula: C12H9NO5S MolecularWeight: 279.26856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)S(=O)CC(=O)O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2)S(=O)CC(=O)O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H9NO5S/c14-12(15)7-19(18)9-4-5-10-8(6-9)2-1-3-11(10)13(16)17/h1-6H,7H2,(H,14,15)