N-[[1-(2-bromoethyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl]benzamide

Systemtic Name: N-[[1-(2-bromoethyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl]benzamide Openeye Name: N-[[1-(2-bromoethyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl]benzamide CAS Name: N-[[1-(2-bromoethyl)-2-pyrrolyl]-(4-methoxyphenyl)methyl]benzamide IUPAC Name: N-[[1-(2-bromoethyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl]benzamide Traditional Name: N-[[1-(2-bromoethyl)pyrrol-2-yl]-(4-methoxyphenyl)methyl]benzamide Formula: C21H21BrN2O2 MolecularWeight: 413.30764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CN2CCBr)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CN2CCBr)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21BrN2O2/c1-26-18-11-9-16(10-12-18)20(19-8-5-14-24(19)15-13-22)23-21(25)17-6-3-2-4-7-17/h2-12,14,20H,13,15H2,1H3,(H,23,25)