[(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-5-bromanyl-benzoate

Systemtic Name: [(2R)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-azanyl-5-bromanyl-benzoate Openeye Name: [(1R)-2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid [(1R)-2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H23BrN2O3 MolecularWeight: 383.28012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)OC(=O)C2=C(C=CC(=C2)Br)N

Isomeric SMILES

C[C@H](C(=O)NCC1CCCCC1)OC(=O)C2=C(C=CC(=C2)Br)N

InChI

InChI=1S/C17H23BrN2O3/c1-11(16(21)20-10-12-5-3-2-4-6-12)23-17(22)14-9-13(18)7-8-15(14)19/h7-9,11-12H,2-6,10,19H2,1H3,(H,20,21)/t11-/m1/s1