[(E)-1-azanyl-1-oxidanylidene-octadec-9-en-2-yl]phosphonic acid; propane

Systemtic Name: [(E)-1-azanyl-1-oxidanylidene-octadec-9-en-2-yl]phosphonic acid; propane Openeye Name: [(E)-1-carbamoylheptadec-8-enyl]phosphonic acid; propane CAS Name: [(E)-1-amino-1-oxooctadec-9-en-2-yl]phosphonic acid; propane IUPAC Name: [(E)-1-amino-1-oxooctadec-9-en-2-yl]phosphonic acid; propane Traditional Name: [(E)-1-carbamoylheptadec-8-enyl]phosphonic acid; n-propane Formula: C21H44NO4P MolecularWeight: 405.552121

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Descriptors Computed from Structure

Canonical SMILES:

CCC.CCCCCCCCC=CCCCCCCC(C(=O)N)P(=O)(O)O

Isomeric SMILES

CCC.CCCCCCCC/C=C/CCCCCCC(C(=O)N)P(=O)(O)O

InChI

InChI=1S/C18H36NO4P.C3H8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18(19)20)24(21,22)23;1-3-2/h9-10,17H,2-8,11-16H2,1H3,(H2,19,20)(H2,21,22,23);3H2,1-2H3/b10-9+;