[2-[1-(4-ethylphenyl)ethylamino]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [2-[1-(4-ethylphenyl)ethylamino]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate Openeye Name: [2-[1-(4-ethylphenyl)ethylamino]-2-oxo-ethyl] 2-[(3-bromobenzoyl)amino]acetate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]acetic acid [2-[1-(4-ethylphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(4-ethylphenyl)ethylamino]-2-oxoethyl] 2-[(3-bromobenzoyl)amino]acetate Traditional Name: 2-[(3-bromobenzoyl)amino]acetic acid [2-[1-(4-ethylphenyl)ethylamino]-2-keto-ethyl] ester Formula: C21H23BrN2O4 MolecularWeight: 447.32232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)COC(=O)CNC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=O)COC(=O)CNC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C21H23BrN2O4/c1-3-15-7-9-16(10-8-15)14(2)24-19(25)13-28-20(26)12-23-21(27)17-5-4-6-18(22)11-17/h4-11,14H,3,12-13H2,1-2H3,(H,23,27)(H,24,25)