3-butyl-2-methanoyl-naphthalene-1-sulfonic acid

Systemtic Name: 3-butyl-2-methanoyl-naphthalene-1-sulfonic acid Openeye Name: 3-butyl-2-formyl-naphthalene-1-sulfonic acid CAS Name: 3-butyl-2-formyl-1-naphthalenesulfonic acid IUPAC Name: 3-butyl-2-formylnaphthalene-1-sulfonic acid Traditional Name: 3-butyl-2-formyl-naphthalene-1-sulfonic acid Formula: C15H16O4S MolecularWeight: 292.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=C1C=O)S(=O)(=O)O

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=C1C=O)S(=O)(=O)O

InChI

InChI=1S/C15H16O4S/c1-2-3-6-12-9-11-7-4-5-8-13(11)15(14(12)10-16)20(17,18)19/h4-5,7-10H,2-3,6H2,1H3,(H,17,18,19)