[2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 3-bromanylbenzoate

Systemtic Name: [2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 3-bromanylbenzoate Openeye Name: [2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxo-ethyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-2-keto-ethyl] ester Formula: C17H15BrClNO3 MolecularWeight: 396.6629

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Cl)NC(=O)COC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)Cl)NC(=O)COC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H15BrClNO3/c1-11(12-5-7-15(19)8-6-12)20-16(21)10-23-17(22)13-3-2-4-14(18)9-13/h2-9,11H,10H2,1H3,(H,20,21)/t11-/m0/s1