(octanoylamino) 2-(3-pentoxyphenyl)ethyl hydrogen phosphate

Systemtic Name: (octanoylamino) 2-(3-pentoxyphenyl)ethyl hydrogen phosphate Openeye Name: (octanoylamino) 2-(3-pentoxyphenyl)ethyl hydrogen phosphate CAS Name: (1-oxooctylamino) 2-(3-pentoxyphenyl)ethyl hydrogen phosphate IUPAC Name: (octanoylamino) 2-(3-pentoxyphenyl)ethyl hydrogen phosphate Traditional Name: 2-(3-amoxyphenyl)ethyl (caprylylamino) hydrogen phosphate Formula: C21H36NO6P MolecularWeight: 429.487401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NOP(=O)(O)OCCC1=CC(=CC=C1)OCCCCC

Isomeric SMILES

CCCCCCCC(=O)NOP(=O)(O)OCCC1=CC(=CC=C1)OCCCCC

InChI

InChI=1S/C21H36NO6P/c1-3-5-7-8-9-14-21(23)22-28-29(24,25)27-17-15-19-12-11-13-20(18-19)26-16-10-6-4-2/h11-13,18H,3-10,14-17H2,1-2H3,(H,22,23)(H,24,25)