ethyl N-[3-(bromomethyl)-1-phenyl-2-(phenylsulfonyl)but-3-enyl]carbamate

Systemtic Name: ethyl N-[3-(bromomethyl)-1-phenyl-2-(phenylsulfonyl)but-3-enyl]carbamate Openeye Name: ethyl N-[2-(benzenesulfonyl)-3-(bromomethyl)-1-phenyl-but-3-enyl]carbamate CAS Name: N-[2-(benzenesulfonyl)-3-(bromomethyl)-1-phenylbut-3-enyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(benzenesulfonyl)-3-(bromomethyl)-1-phenylbut-3-enyl]carbamate Traditional Name: N-[2-besyl-3-(bromomethyl)-1-phenyl-but-3-enyl]carbamic acid ethyl ester Formula: C20H22BrNO4S MolecularWeight: 452.36198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C1=CC=CC=C1)C(C(=C)CBr)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)NC(C1=CC=CC=C1)C(C(=C)CBr)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22BrNO4S/c1-3-26-20(23)22-18(16-10-6-4-7-11-16)19(15(2)14-21)27(24,25)17-12-8-5-9-13-17/h4-13,18-19H,2-3,14H2,1H3,(H,22,23)