(phenylmethyl) (E)-2-[cyclopropyl-(diphenylphosphorylamino)methyl]but-2-enoate

Systemtic Name: (phenylmethyl) (E)-2-[cyclopropyl-(diphenylphosphorylamino)methyl]but-2-enoate Openeye Name: benzyl (E)-2-[cyclopropyl-(diphenylphosphorylamino)methyl]but-2-enoate CAS Name: (E)-2-[cyclopropyl-(diphenylphosphorylamino)methyl]-2-butenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E)-2-[cyclopropyl-(diphenylphosphorylamino)methyl]but-2-enoate Traditional Name: (E)-2-[cyclopropyl-(diphenylphosphorylamino)methyl]but-2-enoic acid benzyl ester Formula: C27H28NO3P MolecularWeight: 445.489881

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C(C1CC1)NP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C/C=C(\C(C1CC1)NP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)/C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H28NO3P/c1-2-25(27(29)31-20-21-12-6-3-7-13-21)26(22-18-19-22)28-32(30,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h2-17,22,26H,18-20H2,1H3,(H,28,30)/b25-2+