methyl (2S)-2-[[(Z)-octadec-9-enoyl]amino]-3-phosphonooxy-propanoate

Systemtic Name: methyl (2S)-2-[[(Z)-octadec-9-enoyl]amino]-3-phosphonooxy-propanoate Openeye Name: methyl (2S)-2-[[(Z)-octadec-9-enoyl]amino]-3-phosphonooxy-propanoate CAS Name: (2S)-2-[[(Z)-1-oxooctadec-9-enyl]amino]-3-phosphonooxypropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(Z)-octadec-9-enoyl]amino]-3-phosphonooxypropanoate Traditional Name: (2S)-2-[[(Z)-octadec-9-enoyl]amino]-3-phosphonooxy-propionic acid methyl ester Formula: C22H42NO7P MolecularWeight: 463.545141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(COP(=O)(O)O)C(=O)OC

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)N[C@@H](COP(=O)(O)O)C(=O)OC

InChI

InChI=1S/C22H42NO7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(24)23-20(22(25)29-2)19-30-31(26,27)28/h10-11,20H,3-9,12-19H2,1-2H3,(H,23,24)(H2,26,27,28)/b11-10-/t20-/m0/s1