tert-butyl N-[(2S)-1-[(3-bromanyl-4-chloranyl-phenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(3-bromanyl-4-chloranyl-phenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(3-bromo-4-chloro-phenyl)carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-(3-bromo-4-chloroanilino)-4-methyl-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(3-bromo-4-chloroanilino)-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(3-bromo-4-chloro-phenyl)carbamoyl]-3-methyl-butyl]carbamic acid tert-butyl ester Formula: C17H24BrClN2O3 MolecularWeight: 419.74106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC(=C(C=C1)Cl)Br)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CC(=C(C=C1)Cl)Br)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H24BrClN2O3/c1-10(2)8-14(21-16(23)24-17(3,4)5)15(22)20-11-6-7-13(19)12(18)9-11/h6-7,9-10,14H,8H2,1-5H3,(H,20,22)(H,21,23)/t14-/m0/s1