(E)-2-[(2-cyclohexylphenyl)methyl]-3-methyl-but-2-enedioic acid

Systemtic Name: (E)-2-[(2-cyclohexylphenyl)methyl]-3-methyl-but-2-enedioic acid Openeye Name: (E)-2-[(2-cyclohexylphenyl)methyl]-3-methyl-but-2-enedioic acid CAS Name: (E)-2-[(2-cyclohexylphenyl)methyl]-3-methyl-2-butenedioic acid IUPAC Name: (E)-2-[(2-cyclohexylphenyl)methyl]-3-methylbut-2-enedioic acid Traditional Name: (E)-2-(2-cyclohexylbenzyl)-3-methyl-but-2-enedioic acid Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CC1=CC=CC=C1C2CCCCC2)C(=O)O)C(=O)O

Isomeric SMILES

C/C(=C(/CC1=CC=CC=C1C2CCCCC2)\C(=O)O)/C(=O)O

InChI

InChI=1S/C18H22O4/c1-12(17(19)20)16(18(21)22)11-14-9-5-6-10-15(14)13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8,11H2,1H3,(H,19,20)(H,21,22)/b16-12+