[2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] 2-azanyl-5-bromanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] 2-azanyl-5-bromanyl-benzoate Openeye Name: [2-oxo-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl] 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid [2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid [2-keto-2-[[(1R)-1-(2-thienyl)ethyl]amino]ethyl] ester Formula: C15H15BrN2O3S MolecularWeight: 383.2602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)COC(=O)C2=C(C=CC(=C2)Br)N

Isomeric SMILES

C[C@H](C1=CC=CS1)NC(=O)COC(=O)C2=C(C=CC(=C2)Br)N

InChI

InChI=1S/C15H15BrN2O3S/c1-9(13-3-2-6-22-13)18-14(19)8-21-15(20)11-7-10(16)4-5-12(11)17/h2-7,9H,8,17H2,1H3,(H,18,19)/t9-/m1/s1