3-(4-methylphenyl)-3-propan-2-yl-decanedioic acid

Systemtic Name: 3-(4-methylphenyl)-3-propan-2-yl-decanedioic acid Openeye Name: 3-isopropyl-3-(p-tolyl)decanedioic acid CAS Name: 3-(4-methylphenyl)-3-propan-2-yldecanedioic acid IUPAC Name: 3-(4-methylphenyl)-3-propan-2-yldecanedioic acid Traditional Name: 3-isopropyl-3-(p-tolyl)sebacic acid Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30O4/c1-15(2)20(14-19(23)24,17-11-9-16(3)10-12-17)13-7-5-4-6-8-18(21)22/h9-12,15H,4-8,13-14H2,1-3H3,(H,21,22)(H,23,24)