1-(1-phenyl-2-phosphono-butan-2-yl)cyclopentane-1-carboxylic acid

Systemtic Name: 1-(1-phenyl-2-phosphono-butan-2-yl)cyclopentane-1-carboxylic acid Openeye Name: 1-(1-benzyl-1-phosphono-propyl)cyclopentanecarboxylic acid CAS Name: 1-(1-phenyl-2-phosphonobutan-2-yl)-1-cyclopentanecarboxylic acid IUPAC Name: 1-(1-phenyl-2-phosphonobutan-2-yl)cyclopentane-1-carboxylic acid Traditional Name: 1-(1-benzyl-1-phosphono-propyl)cyclopentanecarboxylic acid Formula: C16H23O5P MolecularWeight: 326.324581

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)(C2(CCCC2)C(=O)O)P(=O)(O)O

Isomeric SMILES

CCC(CC1=CC=CC=C1)(C2(CCCC2)C(=O)O)P(=O)(O)O

InChI

InChI=1S/C16H23O5P/c1-2-16(22(19,20)21,12-13-8-4-3-5-9-13)15(14(17)18)10-6-7-11-15/h3-5,8-9H,2,6-7,10-12H2,1H3,(H,17,18)(H2,19,20,21)