N-(4-bromanyl-3-methyl-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-[(3-ethoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(3-ethoxybenzyl)isonipecotamide Formula: C22H27BrN2O2 MolecularWeight: 431.36598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=CC(=C(C=C3)Br)C

Isomeric SMILES

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=CC(=C(C=C3)Br)C

InChI

InChI=1S/C22H27BrN2O2/c1-3-27-20-6-4-5-17(14-20)15-25-11-9-18(10-12-25)22(26)24-19-7-8-21(23)16(2)13-19/h4-8,13-14,18H,3,9-12,15H2,1-2H3,(H,24,26)