[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-[(3-bromobenzoyl)amino]acetate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]acetic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-[(3-bromobenzoyl)amino]acetate Traditional Name: 2-[(3-bromobenzoyl)amino]acetic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H22BrN3O5 MolecularWeight: 428.27768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)CNC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)CNC(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C17H22BrN3O5/c1-11(2)6-7-19-17(25)21-14(22)10-26-15(23)9-20-16(24)12-4-3-5-13(18)8-12/h3-5,8,11H,6-7,9-10H2,1-2H3,(H,20,24)(H2,19,21,22,25)