[2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 2-bromanylbenzoate

Systemtic Name: [2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 2-bromanylbenzoate Openeye Name: [2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-keto-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)COC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC1CCCCC1NC(=O)COC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C16H20BrNO3/c1-11-6-2-5-9-14(11)18-15(19)10-21-16(20)12-7-3-4-8-13(12)17/h3-4,7-8,11,14H,2,5-6,9-10H2,1H3,(H,18,19)