2-(octanoylamino)ethyl (3-propan-2-ylthiophen-2-yl) hydrogen phosphate

Systemtic Name: 2-(octanoylamino)ethyl (3-propan-2-ylthiophen-2-yl) hydrogen phosphate Openeye Name: (3-isopropyl-2-thienyl) 2-(octanoylamino)ethyl hydrogen phosphate CAS Name: 2-(1-oxooctylamino)ethyl (3-propan-2-yl-2-thiophenyl) hydrogen phosphate IUPAC Name: 2-(octanoylamino)ethyl (3-propan-2-ylthiophen-2-yl) hydrogen phosphate Traditional Name: 2-(caprylylamino)ethyl (3-isopropyl-2-thienyl) hydrogen phosphate Formula: C17H30NO5PS MolecularWeight: 391.462561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCCOP(=O)(O)OC1=C(C=CS1)C(C)C

Isomeric SMILES

CCCCCCCC(=O)NCCOP(=O)(O)OC1=C(C=CS1)C(C)C

InChI

InChI=1S/C17H30NO5PS/c1-4-5-6-7-8-9-16(19)18-11-12-22-24(20,21)23-17-15(14(2)3)10-13-25-17/h10,13-14H,4-9,11-12H2,1-3H3,(H,18,19)(H,20,21)