methyl 2-[3-[1-(octanoylamino)-2-phosphonooxy-ethyl]phenyl]ethanoate

Systemtic Name: methyl 2-[3-[1-(octanoylamino)-2-phosphonooxy-ethyl]phenyl]ethanoate Openeye Name: methyl 2-[3-[1-(octanoylamino)-2-phosphonooxy-ethyl]phenyl]acetate CAS Name: 2-[3-[1-(1-oxooctylamino)-2-phosphonooxyethyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[1-(octanoylamino)-2-phosphonooxyethyl]phenyl]acetate Traditional Name: 2-[3-[1-(caprylylamino)-2-phosphonooxy-ethyl]phenyl]acetic acid methyl ester Formula: C19H30NO7P MolecularWeight: 415.417761

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(COP(=O)(O)O)C1=CC=CC(=C1)CC(=O)OC

Isomeric SMILES

CCCCCCCC(=O)NC(COP(=O)(O)O)C1=CC=CC(=C1)CC(=O)OC

InChI

InChI=1S/C19H30NO7P/c1-3-4-5-6-7-11-18(21)20-17(14-27-28(23,24)25)16-10-8-9-15(12-16)13-19(22)26-2/h8-10,12,17H,3-7,11,13-14H2,1-2H3,(H,20,21)(H2,23,24,25)