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

Systemtic Name: 1-methoxy-4-phenyl-naphthalene; 2-methylidenebutanedioic acid Openeye Name: 1-methoxy-4-phenyl-naphthalene; 2-methylenebutanedioic acid CAS Name: 1-methoxy-4-phenylnaphthalene; 2-methylenebutanedioic acid IUPAC Name: 1-methoxy-4-phenylnaphthalene; 2-methylidenebutanedioic acid Traditional Name: itaconic acid; 1-methoxy-4-phenyl-naphthalene Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C2=CC=CC=C21)C3=CC=CC=C3.C=C(CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=C(C2=CC=CC=C21)C3=CC=CC=C3.C=C(CC(=O)O)C(=O)O

InChI

InChI=1S/C17H14O.C5H6O4/c1-18-17-12-11-14(13-7-3-2-4-8-13)15-9-5-6-10-16(15)17;1-3(5(8)9)2-4(6)7/h2-12H,1H3;1-2H2,(H,6,7)(H,8,9)