2-[(oxan-3-yloxycarbonylamino)methyl]heptadecyl N-(pyridin-2-ylmethyl)carbamate

Systemtic Name: 2-[(oxan-3-yloxycarbonylamino)methyl]heptadecyl N-(pyridin-2-ylmethyl)carbamate Openeye Name: 2-[(tetrahydropyran-3-yloxycarbonylamino)methyl]heptadecyl N-(2-pyridylmethyl)carbamate CAS Name: N-[2-[[oxo-(2-pyridinylmethylamino)methoxy]methyl]heptadecyl]carbamic acid 3-oxanyl ester IUPAC Name: 2-[(oxan-3-yloxycarbonylamino)methyl]heptadecyl N-(pyridin-2-ylmethyl)carbamate Traditional Name: N-(2-pyridylmethyl)carbamic acid 2-[(tetrahydropyran-3-yloxycarbonylamino)methyl]heptadecyl ester Formula: C31H53N3O5 MolecularWeight: 547.76962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CNC(=O)OC1CCCOC1)COC(=O)NCC2=CC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCC(CNC(=O)OC1CCCOC1)COC(=O)NCC2=CC=CC=N2

InChI

InChI=1S/C31H53N3O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-27(23-33-31(36)39-29-20-17-22-37-26-29)25-38-30(35)34-24-28-19-15-16-21-32-28/h15-16,19,21,27,29H,2-14,17-18,20,22-26H2,1H3,(H,33,36)(H,34,35)