[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 2-[(3-bromophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 2-[(3-bromophenyl)sulfonylamino]ethanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-[(3-bromophenyl)sulfonylamino]acetate CAS Name: 2-[(3-bromophenyl)sulfonylamino]acetic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-[(3-bromophenyl)sulfonylamino]acetate Traditional Name: 2-[(3-bromophenyl)sulfonylamino]acetic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C14H13BrN2O5S MolecularWeight: 401.23242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)S(=O)(=O)NCC(=O)OCC(=O)C2=CC=CN2

Isomeric SMILES

C1=CC(=CC(=C1)Br)S(=O)(=O)NCC(=O)OCC(=O)C2=CC=CN2

InChI

InChI=1S/C14H13BrN2O5S/c15-10-3-1-4-11(7-10)23(20,21)17-8-14(19)22-9-13(18)12-5-2-6-16-12/h1-7,16-17H,8-9H2