6-[oxidanyl(4-phenylbutyl)phosphoryl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[oxidanyl(4-phenylbutyl)phosphoryl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[hydroxy(4-phenylbutyl)phosphoryl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[hydroxy(4-phenylbutyl)phosphoryl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[hydroxy(4-phenylbutyl)phosphoryl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[hydroxy(4-phenylbutyl)phosphoryl]cyclohex-3-ene-1-carboxylic acid Formula: C17H23O4P MolecularWeight: 322.335881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)O)P(=O)(CCCCC2=CC=CC=C2)O

Isomeric SMILES

C1C=CCC(C1C(=O)O)P(=O)(CCCCC2=CC=CC=C2)O

InChI

InChI=1S/C17H23O4P/c18-17(19)15-11-4-5-12-16(15)22(20,21)13-7-6-10-14-8-2-1-3-9-14/h1-5,8-9,15-16H,6-7,10-13H2,(H,18,19)(H,20,21)