(2-isocyano-4-pentyl-phenyl) 4-(prop-2-enoyloxymethyl)benzoate

Systemtic Name: (2-isocyano-4-pentyl-phenyl) 4-(prop-2-enoyloxymethyl)benzoate Openeye Name: (2-isocyano-4-pentyl-phenyl) 4-(prop-2-enoyloxymethyl)benzoate CAS Name: 4-(1-oxoprop-2-enoxymethyl)benzoic acid (2-isocyano-4-pentylphenyl) ester IUPAC Name: (2-isocyano-4-pentylphenyl) 4-(prop-2-enoyloxymethyl)benzoate Traditional Name: 4-(acryloyloxymethyl)benzoic acid (4-amyl-2-isocyano-phenyl) ester Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)COC(=O)C=C)[N+]#[C-]

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)COC(=O)C=C)[N+]#[C-]

InChI

InChI=1S/C23H23NO4/c1-4-6-7-8-17-11-14-21(20(15-17)24-3)28-23(26)19-12-9-18(10-13-19)16-27-22(25)5-2/h5,9-15H,2,4,6-8,16H2,1H3