2-[2-[2-(diethoxyphosphorylmethyl)phenoxy]ethyl]-4-hexyl-1,4-benzoxazin-3-one

Systemtic Name: 2-[2-[2-(diethoxyphosphorylmethyl)phenoxy]ethyl]-4-hexyl-1,4-benzoxazin-3-one Openeye Name: 2-[2-[2-(diethoxyphosphorylmethyl)phenoxy]ethyl]-4-hexyl-1,4-benzoxazin-3-one CAS Name: 2-[2-[2-(diethoxyphosphorylmethyl)phenoxy]ethyl]-4-hexyl-1,4-benzoxazin-3-one IUPAC Name: 2-[2-[2-(diethoxyphosphorylmethyl)phenoxy]ethyl]-4-hexyl-1,4-benzoxazin-3-one Traditional Name: 2-[2-[2-(diethoxyphosphorylmethyl)phenoxy]ethyl]-4-hexyl-1,4-benzoxazin-3-one Formula: C27H38NO6P MolecularWeight: 503.567481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CP(=O)(OCC)OCC

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CP(=O)(OCC)OCC

InChI

InChI=1S/C27H38NO6P/c1-4-7-8-13-19-28-23-15-10-12-17-25(23)34-26(27(28)29)18-20-31-24-16-11-9-14-22(24)21-35(30,32-5-2)33-6-3/h9-12,14-17,26H,4-8,13,18-21H2,1-3H3