methyl (E)-2-azido-3-[4-[bis(ethylperoxy)phosphoryl-oxidanyl-methyl]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-2-azido-3-[4-[bis(ethylperoxy)phosphoryl-oxidanyl-methyl]phenyl]prop-2-enoate Openeye Name: methyl (E)-2-azido-3-[4-[bis(ethylperoxy)phosphoryl-hydroxy-methyl]phenyl]prop-2-enoate CAS Name: (E)-2-azido-3-[4-[bis(ethyldioxy)phosphoryl-hydroxymethyl]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-azido-3-[4-[bis(ethylperoxy)phosphoryl-hydroxymethyl]phenyl]prop-2-enoate Traditional Name: (E)-2-azido-3-[4-[bis(ethylperoxy)phosphoryl-hydroxy-methyl]phenyl]acrylic acid methyl ester Formula: C15H20N3O8P MolecularWeight: 401.308361

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Descriptors Computed from Structure

Canonical SMILES:

CCOOP(=O)(C(C1=CC=C(C=C1)C=C(C(=O)OC)N=[N+]=[N-])O)OOCC

Isomeric SMILES

CCOOP(=O)(C(C1=CC=C(C=C1)/C=C(\C(=O)OC)/N=[N+]=[N-])O)OOCC

InChI

InChI=1S/C15H20N3O8P/c1-4-23-25-27(21,26-24-5-2)15(20)12-8-6-11(7-9-12)10-13(17-18-16)14(19)22-3/h6-10,15,20H,4-5H2,1-3H3/b13-10+