[2-[ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-[ethyl-[2-(isopropylamino)-2-oxo-ethyl]amino]-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-[ethyl-[2-(isopropylamino)-2-keto-ethyl]amino]-2-keto-ethyl] ester Formula: C14H20BrN3O4 MolecularWeight: 374.2303

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)C)C(=O)COC(=O)C1=CC(=CN1)Br

Isomeric SMILES

CCN(CC(=O)NC(C)C)C(=O)COC(=O)C1=CC(=CN1)Br

InChI

InChI=1S/C14H20BrN3O4/c1-4-18(7-12(19)17-9(2)3)13(20)8-22-14(21)11-5-10(15)6-16-11/h5-6,9,16H,4,7-8H2,1-3H3,(H,17,19)