2-(9-phenylmethoxynon-1-en-4-yl)propanedioic acid

Systemtic Name: 2-(9-phenylmethoxynon-1-en-4-yl)propanedioic acid Openeye Name: 2-(1-allyl-6-benzyloxy-hexyl)propanedioic acid CAS Name: 2-(9-phenylmethoxynon-1-en-4-yl)propanedioic acid IUPAC Name: 2-(9-phenylmethoxynon-1-en-4-yl)propanedioic acid Traditional Name: 2-[1-(5-benzoxypentyl)but-3-enyl]malonic acid Formula: C19H26O5 MolecularWeight: 334.40674

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CCCCCOCC1=CC=CC=C1)C(C(=O)O)C(=O)O

Isomeric SMILES

C=CCC(CCCCCOCC1=CC=CC=C1)C(C(=O)O)C(=O)O

InChI

InChI=1S/C19H26O5/c1-2-9-16(17(18(20)21)19(22)23)12-7-4-8-13-24-14-15-10-5-3-6-11-15/h2-3,5-6,10-11,16-17H,1,4,7-9,12-14H2,(H,20,21)(H,22,23)