4-butan-2-yl-3-(6-methylheptyl)phthalic acid

Systemtic Name: 4-butan-2-yl-3-(6-methylheptyl)phthalic acid Openeye Name: 3-(6-methylheptyl)-4-sec-butyl-phthalic acid CAS Name: 4-butan-2-yl-3-(6-methylheptyl)phthalic acid IUPAC Name: 4-butan-2-yl-3-(6-methylheptyl)phthalic acid Traditional Name: 3-(6-methylheptyl)-4-sec-butyl-phthalic acid Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCC(C)C

Isomeric SMILES

CCC(C)C1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCC(C)C

InChI

InChI=1S/C20H30O4/c1-5-14(4)15-11-12-17(19(21)22)18(20(23)24)16(15)10-8-6-7-9-13(2)3/h11-14H,5-10H2,1-4H3,(H,21,22)(H,23,24)