2-[(2-bromophenyl)methyl-methyl-amino]-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)ethanone; ethanedioic acid

Systemtic Name: 2-[(2-bromophenyl)methyl-methyl-amino]-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)ethanone; ethanedioic acid Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(2-bromophenyl)methyl-methyl-amino]ethanone; oxalic acid CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(2-bromophenyl)methyl-methylamino]ethanone; oxalic acid IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(2-bromophenyl)methyl-methylamino]ethanone; oxalic acid Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(2-bromobenzyl)-methyl-amino]ethanone; oxalic acid Formula: C20H23BrN2O6 MolecularWeight: 467.31042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)CN(C)CC2=CC=CC=C2Br.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)CN(C)CC2=CC=CC=C2Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H21BrN2O2.C2H2O4/c1-11-17(13(3)22)12(2)20-18(11)16(23)10-21(4)9-14-7-5-6-8-15(14)19;3-1(4)2(5)6/h5-8,20H,9-10H2,1-4H3;(H,3,4)(H,5,6)