2-bromanyl-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-5-methoxy-benzamide Openeye Name: 2-bromo-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-5-methoxy-benzamide CAS Name: 2-bromo-N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-5-methoxybenzamide IUPAC Name: 2-bromo-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-5-methoxybenzamide Traditional Name: 2-bromo-N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-5-methoxy-benzamide Formula: C22H28BrN3O2 MolecularWeight: 446.38062

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=C(C=CC(=C2)OC)Br)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=C(C=CC(=C2)OC)Br)N3CCCC3

InChI

InChI=1S/C22H28BrN3O2/c1-25(2)17-8-6-16(7-9-17)21(26-12-4-5-13-26)15-24-22(27)19-14-18(28-3)10-11-20(19)23/h6-11,14,21H,4-5,12-13,15H2,1-3H3,(H,24,27)