[1-(3-butylphenyl)-4-(hydroxymethyl)octan-2-yl]phosphonic acid

Systemtic Name: [1-(3-butylphenyl)-4-(hydroxymethyl)octan-2-yl]phosphonic acid Openeye Name: [1-[(3-butylphenyl)methyl]-3-(hydroxymethyl)heptyl]phosphonic acid CAS Name: [1-(3-butylphenyl)-4-(hydroxymethyl)octan-2-yl]phosphonic acid IUPAC Name: [1-(3-butylphenyl)-4-(hydroxymethyl)octan-2-yl]phosphonic acid Traditional Name: [1-(3-butylbenzyl)-3-methylol-heptyl]phosphonic acid Formula: C19H33O4P MolecularWeight: 356.436681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)CC(CC(CCCC)CO)P(=O)(O)O

Isomeric SMILES

CCCCC1=CC(=CC=C1)CC(CC(CCCC)CO)P(=O)(O)O

InChI

InChI=1S/C19H33O4P/c1-3-5-8-16-10-7-11-17(12-16)13-19(24(21,22)23)14-18(15-20)9-6-4-2/h7,10-12,18-20H,3-6,8-9,13-15H2,1-2H3,(H2,21,22,23)