3-[[4-[methyl(octyl)carbamoyl]phenyl]methylamino]propylphosphonic acid

Systemtic Name: 3-[[4-[methyl(octyl)carbamoyl]phenyl]methylamino]propylphosphonic acid Openeye Name: 3-[[4-[methyl(octyl)carbamoyl]phenyl]methylamino]propylphosphonic acid CAS Name: 3-[[4-[[methyl(octyl)amino]-oxomethyl]phenyl]methylamino]propylphosphonic acid IUPAC Name: 3-[[4-[methyl(octyl)carbamoyl]phenyl]methylamino]propylphosphonic acid Traditional Name: 3-[[4-[methyl(octyl)carbamoyl]benzyl]amino]propylphosphonic acid Formula: C20H35N2O4P MolecularWeight: 398.476661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C)C(=O)C1=CC=C(C=C1)CNCCCP(=O)(O)O

Isomeric SMILES

CCCCCCCCN(C)C(=O)C1=CC=C(C=C1)CNCCCP(=O)(O)O

InChI

InChI=1S/C20H35N2O4P/c1-3-4-5-6-7-8-15-22(2)20(23)19-12-10-18(11-13-19)17-21-14-9-16-27(24,25)26/h10-13,21H,3-9,14-17H2,1-2H3,(H2,24,25,26)