[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C17H19BrN2O4 MolecularWeight: 395.24776

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H19BrN2O4/c18-13-5-4-6-14(9-13)23-11-16(22)24-10-15(21)20-17(12-19)7-2-1-3-8-17/h4-6,9H,1-3,7-8,10-11H2,(H,20,21)