1-methoxy-4-phenyl-benzene; 2-methylidenebutanedioic acid

Systemtic Name: 1-methoxy-4-phenyl-benzene; 2-methylidenebutanedioic acid Openeye Name: 1-methoxy-4-phenyl-benzene; 2-methylenebutanedioic acid CAS Name: 1-methoxy-4-phenylbenzene; 2-methylenebutanedioic acid IUPAC Name: 1-methoxy-4-phenylbenzene; 2-methylidenebutanedioic acid Traditional Name: itaconic acid; 1-methoxy-4-phenyl-benzene Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=CC=C2.C=C(CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=CC=C2.C=C(CC(=O)O)C(=O)O

InChI

InChI=1S/C13H12O.C5H6O4/c1-14-13-9-7-12(8-10-13)11-5-3-2-4-6-11;1-3(5(8)9)2-4(6)7/h2-10H,1H3;1-2H2,(H,6,7)(H,8,9)