3-bromanyl-2,5-dimethoxy-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-bromanyl-2,5-dimethoxy-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-bromo-2,5-dimethoxy-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-bromo-2,5-dimethoxy-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-bromo-2,5-dimethoxy-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-bromo-2,5-dimethoxy-N-[4-(pyrrolidinomethyl)benzyl]benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCC3)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCC3)OC)Br

InChI

InChI=1S/C21H25BrN2O3/c1-26-17-11-18(20(27-2)19(22)12-17)21(25)23-13-15-5-7-16(8-6-15)14-24-9-3-4-10-24/h5-8,11-12H,3-4,9-10,13-14H2,1-2H3,(H,23,25)