[1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 2-[(4-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 2-[(4-bromophenyl)carbonylamino]ethanoate Openeye Name: [1-methyl-2-oxo-2-(1-phenylbutylamino)ethyl] 2-[(4-bromobenzoyl)amino]acetate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]acetic acid [1-oxo-1-(1-phenylbutylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylbutylamino)propan-2-yl] 2-[(4-bromobenzoyl)amino]acetate Traditional Name: 2-[(4-bromobenzoyl)amino]acetic acid [2-keto-1-methyl-2-(1-phenylbutylamino)ethyl] ester Formula: C22H25BrN2O4 MolecularWeight: 461.3489

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)CNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)CNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C22H25BrN2O4/c1-3-7-19(16-8-5-4-6-9-16)25-21(27)15(2)29-20(26)14-24-22(28)17-10-12-18(23)13-11-17/h4-6,8-13,15,19H,3,7,14H2,1-2H3,(H,24,28)(H,25,27)