[(2S)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(1,2-benzoxazol-3-yl)ethanoate

Systemtic Name: [(2S)-1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(1,2-benzoxazol-3-yl)ethanoate Openeye Name: [(1S)-2-(4-bromoanilino)-1-methyl-2-oxo-ethyl] 2-(1,2-benzoxazol-3-yl)acetate CAS Name: 2-(1,2-benzoxazol-3-yl)acetic acid [(2S)-1-(4-bromoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-bromoanilino)-1-oxopropan-2-yl] 2-(1,2-benzoxazol-3-yl)acetate Traditional Name: 2-indoxazen-3-ylacetic acid [(1S)-2-(4-bromoanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Br)OC(=O)CC2=NOC3=CC=CC=C32

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)Br)OC(=O)CC2=NOC3=CC=CC=C32

InChI

InChI=1S/C18H15BrN2O4/c1-11(18(23)20-13-8-6-12(19)7-9-13)24-17(22)10-15-14-4-2-3-5-16(14)25-21-15/h2-9,11H,10H2,1H3,(H,20,23)/t11-/m0/s1