methyl 2-(2-bromanylethanoylamino)-4-chloranyl-6-[(E)-hex-1-enyl]benzoate

Systemtic Name: methyl 2-(2-bromanylethanoylamino)-4-chloranyl-6-[(E)-hex-1-enyl]benzoate Openeye Name: methyl 2-[(2-bromoacetyl)amino]-4-chloro-6-[(E)-hex-1-enyl]benzoate CAS Name: 2-[(2-bromo-1-oxoethyl)amino]-4-chloro-6-[(E)-hex-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(2-bromoacetyl)amino]-4-chloro-6-[(E)-hex-1-enyl]benzoate Traditional Name: 2-[(2-bromoacetyl)amino]-4-chloro-6-[(E)-hex-1-enyl]benzoic acid methyl ester Formula: C16H19BrClNO3 MolecularWeight: 388.68396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1=CC(=CC(=C1C(=O)OC)NC(=O)CBr)Cl

Isomeric SMILES

CCCC/C=C/C1=CC(=CC(=C1C(=O)OC)NC(=O)CBr)Cl

InChI

InChI=1S/C16H19BrClNO3/c1-3-4-5-6-7-11-8-12(18)9-13(19-14(20)10-17)15(11)16(21)22-2/h6-9H,3-5,10H2,1-2H3,(H,19,20)/b7-6+