4-[(2-hydroxyphenyl)methyl]-3-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 4-[(2-hydroxyphenyl)methyl]-3-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 3-hydroxy-4-[(2-hydroxyphenyl)methyl]naphthalene-1-sulfonic acid CAS Name: 3-hydroxy-4-[(2-hydroxyphenyl)methyl]-1-naphthalenesulfonic acid IUPAC Name: 3-hydroxy-4-[(2-hydroxyphenyl)methyl]naphthalene-1-sulfonic acid Traditional Name: 3-hydroxy-4-salicyl-naphthalene-1-sulfonic acid Formula: C17H14O5S MolecularWeight: 330.35506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=C(C=C(C3=CC=CC=C32)S(=O)(=O)O)O)O

InChI

InChI=1S/C17H14O5S/c18-15-8-4-1-5-11(15)9-14-12-6-2-3-7-13(12)17(10-16(14)19)23(20,21)22/h1-8,10,18-19H,9H2,(H,20,21,22)