[2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 2-azanyl-3-methyl-benzoate

Systemtic Name: [2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-2-oxidanylidene-ethyl] 2-azanyl-3-methyl-benzoate Openeye Name: [2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-2-oxo-ethyl] 2-amino-3-methyl-benzoate CAS Name: 2-amino-3-methylbenzoic acid [2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-2-oxoethyl] 2-amino-3-methylbenzoate Traditional Name: 2-amino-3-methyl-benzoic acid [2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-2-keto-ethyl] ester Formula: C18H19BrN2O3 MolecularWeight: 391.25906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1N)C(=O)OCC(=O)NC(C)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC=CC(=C1N)C(=O)OCC(=O)N[C@H](C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H19BrN2O3/c1-11-4-3-5-15(17(11)20)18(23)24-10-16(22)21-12(2)13-6-8-14(19)9-7-13/h3-9,12H,10,20H2,1-2H3,(H,21,22)/t12-/m1/s1