3-naphthalen-1-yl-6-sulfo-phthalic acid

Systemtic Name: 3-naphthalen-1-yl-6-sulfo-phthalic acid Openeye Name: 3-(1-naphthyl)-6-sulfo-phthalic acid CAS Name: 3-(1-naphthalenyl)-6-sulfophthalic acid IUPAC Name: 3-naphthalen-1-yl-6-sulfophthalic acid Traditional Name: 3-(1-naphthyl)-6-sulfo-phthalic acid Formula: C18H12O7S MolecularWeight: 372.34868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=C(C(=C(C=C3)S(=O)(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=C(C(=C(C=C3)S(=O)(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C18H12O7S/c19-17(20)15-13(8-9-14(26(23,24)25)16(15)18(21)22)12-7-3-5-10-4-1-2-6-11(10)12/h1-9H,(H,19,20)(H,21,22)(H,23,24,25)