(phenylmethyl) N-[(E,1R)-1-(4-bromophenyl)-2-methanoyl-pent-2-enyl]carbamate

Systemtic Name: (phenylmethyl) N-[(E,1R)-1-(4-bromophenyl)-2-methanoyl-pent-2-enyl]carbamate Openeye Name: benzyl N-[(E,1R)-1-(4-bromophenyl)-2-formyl-pent-2-enyl]carbamate CAS Name: N-[(E,1R)-1-(4-bromophenyl)-2-formylpent-2-enyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(E,1R)-1-(4-bromophenyl)-2-formylpent-2-enyl]carbamate Traditional Name: N-[(E,1R)-1-(4-bromophenyl)-2-formyl-pent-2-enyl]carbamic acid benzyl ester Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C=O)C(C1=CC=C(C=C1)Br)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC/C=C(/C=O)\[C@@H](C1=CC=C(C=C1)Br)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H20BrNO3/c1-2-6-17(13-23)19(16-9-11-18(21)12-10-16)22-20(24)25-14-15-7-4-3-5-8-15/h3-13,19H,2,14H2,1H3,(H,22,24)/b17-6-/t19-/m1/s1