[2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 4-ethoxybenzoate

Systemtic Name: [2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 4-ethoxybenzoate Openeye Name: [2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-2-oxo-ethyl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid [2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-2-oxoethyl] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [2-[[(1S)-1-(2-bromophenyl)ethyl]amino]-2-keto-ethyl] ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OCC(=O)NC(C)C2=CC=CC=C2Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OCC(=O)N[C@@H](C)C2=CC=CC=C2Br

InChI

InChI=1S/C19H20BrNO4/c1-3-24-15-10-8-14(9-11-15)19(23)25-12-18(22)21-13(2)16-6-4-5-7-17(16)20/h4-11,13H,3,12H2,1-2H3,(H,21,22)/t13-/m0/s1