2-heptyl-2-phenyl-butanedioic acid

Systemtic Name: 2-heptyl-2-phenyl-butanedioic acid Openeye Name: 2-heptyl-2-phenyl-butanedioic acid CAS Name: 2-heptyl-2-phenylbutanedioic acid IUPAC Name: 2-heptyl-2-phenylbutanedioic acid Traditional Name: 2-heptyl-2-phenyl-succinic acid Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC(=O)O)(C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCCCCCC(CC(=O)O)(C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C17H24O4/c1-2-3-4-5-9-12-17(16(20)21,13-15(18)19)14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3,(H,18,19)(H,20,21)