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

Systemtic Name: [2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 2-[(3-bromophenyl)carbonylamino]ethanoate Openeye Name: [2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 2-[(3-bromobenzoyl)amino]acetate CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]acetic acid [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] 2-[(3-bromobenzoyl)amino]acetate Traditional Name: 2-[(3-bromobenzoyl)amino]acetic acid [2-keto-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C18H23BrN2O4 MolecularWeight: 411.29022

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)COC(=O)CNC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CC1CCCCC1NC(=O)COC(=O)CNC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C18H23BrN2O4/c1-12-5-2-3-8-15(12)21-16(22)11-25-17(23)10-20-18(24)13-6-4-7-14(19)9-13/h4,6-7,9,12,15H,2-3,5,8,10-11H2,1H3,(H,20,24)(H,21,22)