methyl 3-[[(1R)-1-(2-bromophenyl)ethyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[(1R)-1-(2-bromophenyl)ethyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[(1R)-1-(2-bromophenyl)ethyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[(1R)-1-(2-bromophenyl)ethyl]amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[(1R)-1-(2-bromophenyl)ethyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[(1R)-1-(2-bromophenyl)ethyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C17H15BrN2O5 MolecularWeight: 407.2154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1Br)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H15BrN2O5/c1-10(14-5-3-4-6-15(14)18)19-16(21)11-7-12(17(22)25-2)9-13(8-11)20(23)24/h3-10H,1-2H3,(H,19,21)/t10-/m1/s1