hexyl N-(2-methyl-2-phosphonooxy-1-pyridin-3-yl-propyl)carbamate

Systemtic Name: hexyl N-(2-methyl-2-phosphonooxy-1-pyridin-3-yl-propyl)carbamate Openeye Name: hexyl N-[2-methyl-2-phosphonooxy-1-(3-pyridyl)propyl]carbamate CAS Name: N-[2-methyl-2-phosphonooxy-1-(3-pyridinyl)propyl]carbamic acid hexyl ester IUPAC Name: hexyl N-(2-methyl-2-phosphonooxy-1-pyridin-3-ylpropyl)carbamate Traditional Name: N-[2-methyl-2-phosphonooxy-1-(3-pyridyl)propyl]carbamic acid hexyl ester Formula: C16H27N2O6P MolecularWeight: 374.369141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)NC(C1=CN=CC=C1)C(C)(C)OP(=O)(O)O

Isomeric SMILES

CCCCCCOC(=O)NC(C1=CN=CC=C1)C(C)(C)OP(=O)(O)O

InChI

InChI=1S/C16H27N2O6P/c1-4-5-6-7-11-23-15(19)18-14(13-9-8-10-17-12-13)16(2,3)24-25(20,21)22/h8-10,12,14H,4-7,11H2,1-3H3,(H,18,19)(H2,20,21,22)