1-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[(2-bromanyl-3,4-dimethoxy-phenyl)methyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[(2-bromo-3,4-dimethoxy-phenyl)methyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[(2-bromo-3,4-dimethoxyphenyl)methyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[(2-bromo-3,4-dimethoxyphenyl)methyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-(2-bromo-3,4-dimethoxy-benzyl)-N-phenyl-nipecotamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCCC(C2)C(=O)NC3=CC=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCCC(C2)C(=O)NC3=CC=CC=C3)Br)OC

InChI

InChI=1S/C21H25BrN2O3/c1-26-18-11-10-15(19(22)20(18)27-2)13-24-12-6-7-16(14-24)21(25)23-17-8-4-3-5-9-17/h3-5,8-11,16H,6-7,12-14H2,1-2H3,(H,23,25)