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

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

Systemtic Name:3-[(3-methyl-4-nonanoyl-phenyl)methylamino]propylphosphonic acid
Openeye Name:3-[(3-methyl-4-nonanoyl-phenyl)methylamino]propylphosphonic acid
CAS Name:3-[[3-methyl-4-(1-oxononyl)phenyl]methylamino]propylphosphonic acid
IUPAC Name:3-[(3-methyl-4-nonanoylphenyl)methylamino]propylphosphonic acid
Traditional Name:3-[(3-methyl-4-pelargonyl-benzyl)amino]propylphosphonic acid
Formula: C20H34NO4P
MolecularWeight: 383.462021
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C1=C(C=C(C=C1)CNCCCP(=O)(O)O)C


Isomeric SMILES

CCCCCCCCC(=O)C1=C(C=C(C=C1)CNCCCP(=O)(O)O)C


InChI

InChI=1S/C20H34NO4P/c1-3-4-5-6-7-8-10-20(22)19-12-11-18(15-17(19)2)16-21-13-9-14-26(23,24)25/h11-12,15,21H,3-10,13-14,16H2,1-2H3,(H2,23,24,25)


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