[3-[(2-bromanyl-4-methoxy-phenyl)carbamoyl]-2,5-dihydropyrrol-1-yl] 2-phenylethanoate

Systemtic Name: [3-[(2-bromanyl-4-methoxy-phenyl)carbamoyl]-2,5-dihydropyrrol-1-yl] 2-phenylethanoate Openeye Name: [3-[(2-bromo-4-methoxy-phenyl)carbamoyl]-2,5-dihydropyrrol-1-yl] 2-phenylacetate CAS Name: 2-phenylacetic acid [3-[(2-bromo-4-methoxyanilino)-oxomethyl]-2,5-dihydropyrrol-1-yl] ester IUPAC Name: [3-[(2-bromo-4-methoxyphenyl)carbamoyl]-2,5-dihydropyrrol-1-yl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [3-[(2-bromo-4-methoxy-phenyl)carbamoyl]-3-pyrrolin-1-yl] ester Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CCN(C2)OC(=O)CC3=CC=CC=C3)Br

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CCN(C2)OC(=O)CC3=CC=CC=C3)Br

InChI

InChI=1S/C20H19BrN2O4/c1-26-16-7-8-18(17(21)12-16)22-20(25)15-9-10-23(13-15)27-19(24)11-14-5-3-2-4-6-14/h2-9,12H,10-11,13H2,1H3,(H,22,25)