ethyl 4-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylate

Systemtic Name: ethyl 4-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylate Openeye Name: ethyl 4-[2-(2-bromoanilino)-2-oxo-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylate CAS Name: 4-[2-(2-bromoanilino)-2-oxoethyl]-1-methyl-5-pyrrolo[3,2-b]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-bromoanilino)-2-oxoethyl]-1-methylpyrrolo[3,2-b]pyrrole-5-carboxylate Traditional Name: 4-[2-(2-bromoanilino)-2-keto-ethyl]-1-methyl-pyrrolo[3,2-b]pyrrole-5-carboxylic acid ethyl ester Formula: C18H18BrN3O3 MolecularWeight: 404.25782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC(=O)NC3=CC=CC=C3Br)C=CN2C

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC(=O)NC3=CC=CC=C3Br)C=CN2C

InChI

InChI=1S/C18H18BrN3O3/c1-3-25-18(24)16-10-15-14(8-9-21(15)2)22(16)11-17(23)20-13-7-5-4-6-12(13)19/h4-10H,3,11H2,1-2H3,(H,20,23)