[[[(E)-octadec-9-enyl]amino]-phenyl-methyl]phosphonic acid

Systemtic Name: [[[(E)-octadec-9-enyl]amino]-phenyl-methyl]phosphonic acid Openeye Name: [[[(E)-octadec-9-enyl]amino]-phenyl-methyl]phosphonic acid CAS Name: [[[(E)-octadec-9-enyl]amino]-phenylmethyl]phosphonic acid IUPAC Name: [[[(E)-octadec-9-enyl]amino]-phenylmethyl]phosphonic acid Traditional Name: [[[(E)-octadec-9-enyl]amino]-phenyl-methyl]phosphonic acid Formula: C25H44NO3P MolecularWeight: 437.595521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNC(C1=CC=CC=C1)P(=O)(O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNC(C1=CC=CC=C1)P(=O)(O)O

InChI

InChI=1S/C25H44NO3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26-25(30(27,28)29)24-21-18-17-19-22-24/h9-10,17-19,21-22,25-26H,2-8,11-16,20,23H2,1H3,(H2,27,28,29)/b10-9+