(Z)-2-(2-methoxyethyl)-3-[2-(3-methylphenyl)-2-oxidanylidene-ethyl]but-2-enedioic acid

Systemtic Name: (Z)-2-(2-methoxyethyl)-3-[2-(3-methylphenyl)-2-oxidanylidene-ethyl]but-2-enedioic acid Openeye Name: (Z)-2-(2-methoxyethyl)-3-[2-(m-tolyl)-2-oxo-ethyl]but-2-enedioic acid CAS Name: (Z)-2-(2-methoxyethyl)-3-[2-(3-methylphenyl)-2-oxoethyl]-2-butenedioic acid IUPAC Name: (Z)-2-(2-methoxyethyl)-3-[2-(3-methylphenyl)-2-oxoethyl]but-2-enedioic acid Traditional Name: (Z)-2-[2-keto-2-(m-tolyl)ethyl]-3-(2-methoxyethyl)but-2-enedioic acid Formula: C16H18O6 MolecularWeight: 306.31052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C/C(=C(\CCOC)/C(=O)O)/C(=O)O

InChI

InChI=1S/C16H18O6/c1-10-4-3-5-11(8-10)14(17)9-13(16(20)21)12(15(18)19)6-7-22-2/h3-5,8H,6-7,9H2,1-2H3,(H,18,19)(H,20,21)/b13-12-