4-ethyl-3-(6-methylheptyl)phthalic acid

Systemtic Name: 4-ethyl-3-(6-methylheptyl)phthalic acid Openeye Name: 4-ethyl-3-(6-methylheptyl)phthalic acid CAS Name: 4-ethyl-3-(6-methylheptyl)phthalic acid IUPAC Name: 4-ethyl-3-(6-methylheptyl)phthalic acid Traditional Name: 4-ethyl-3-(6-methylheptyl)phthalic acid Formula: C18H26O4 MolecularWeight: 306.39664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCC(C)C

Isomeric SMILES

CCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCCCC(C)C

InChI

InChI=1S/C18H26O4/c1-4-13-10-11-15(17(19)20)16(18(21)22)14(13)9-7-5-6-8-12(2)3/h10-12H,4-9H2,1-3H3,(H,19,20)(H,21,22)