ethanedioic acid; methanal; 3-methylphenol; 4-methylphenol

Systemtic Name: ethanedioic acid; methanal; 3-methylphenol; 4-methylphenol Openeye Name: formaldehyde; m-cresol; oxalic acid; p-cresol CAS Name: formaldehyde; 3-methylphenol; 4-methylphenol; oxalic acid IUPAC Name: formaldehyde; 3-methylphenol; 4-methylphenol; oxalic acid Traditional Name: formaldehyde; m-cresol; oxalic acid; p-cresol Formula: C17H20O7 MolecularWeight: 336.3365

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)O.CC1=CC(=CC=C1)O.C=O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)O.CC1=CC(=CC=C1)O.C=O.C(=O)(C(=O)O)O

InChI

InChI=1S/2C7H8O.C2H2O4.CH2O/c1-6-2-4-7(8)5-3-6;1-6-3-2-4-7(8)5-6;3-1(4)2(5)6;1-2/h2*2-5,8H,1H3;(H,3,4)(H,5,6);1H2