tert-butyl N-[2-[5-cyano-2-[(E)-2-phosphonooxyethenyl]phenoxy]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[5-cyano-2-[(E)-2-phosphonooxyethenyl]phenoxy]ethyl]carbamate Openeye Name: tert-butyl N-[2-[5-cyano-2-[(E)-2-phosphonooxyvinyl]phenoxy]ethyl]carbamate CAS Name: N-[2-[5-cyano-2-[(E)-2-phosphonooxyethenyl]phenoxy]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[5-cyano-2-[(E)-2-phosphonooxyethenyl]phenoxy]ethyl]carbamate Traditional Name: N-[2-[5-cyano-2-[(E)-2-phosphonooxyvinyl]phenoxy]ethyl]carbamic acid tert-butyl ester Formula: C16H21N2O7P MolecularWeight: 384.320901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCOC1=C(C=CC(=C1)C#N)C=COP(=O)(O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCOC1=C(C=CC(=C1)C#N)/C=C/OP(=O)(O)O

InChI

InChI=1S/C16H21N2O7P/c1-16(2,3)25-15(19)18-7-9-23-14-10-12(11-17)4-5-13(14)6-8-24-26(20,21)22/h4-6,8,10H,7,9H2,1-3H3,(H,18,19)(H2,20,21,22)/b8-6+