4-azanylbenzenesulfonic acid; methanal; 2-methoxyphenol

Systemtic Name: 4-azanylbenzenesulfonic acid; methanal; 2-methoxyphenol Openeye Name: 4-aminobenzenesulfonic acid; formaldehyde; 2-methoxyphenol CAS Name: 4-aminobenzenesulfonic acid; formaldehyde; 2-methoxyphenol IUPAC Name: 4-aminobenzenesulfonic acid; formaldehyde; 2-methoxyphenol Traditional Name: 4-aminobesylic acid; formaldehyde; guaiacol Formula: C14H17NO6S MolecularWeight: 327.35288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1O.C=O.C1=CC(=CC=C1N)S(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1O.C=O.C1=CC(=CC=C1N)S(=O)(=O)O

InChI

InChI=1S/C7H8O2.C6H7NO3S.CH2O/c1-9-7-5-3-2-4-6(7)8;7-5-1-3-6(4-2-5)11(8,9)10;1-2/h2-5,8H,1H3;1-4H,7H2,(H,8,9,10);1H2