N-(4-bromanyl-3-methyl-phenyl)-1-(3,5-dimethoxyphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-(3,5-dimethoxyphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-[(3,5-dimethoxyphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(3,5-dimethoxybenzoyl)isonipecotamide Formula: C22H25BrN2O4 MolecularWeight: 461.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC(=CC(=C3)OC)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC(=CC(=C3)OC)OC)Br

InChI

InChI=1S/C22H25BrN2O4/c1-14-10-17(4-5-20(14)23)24-21(26)15-6-8-25(9-7-15)22(27)16-11-18(28-2)13-19(12-16)29-3/h4-5,10-13,15H,6-9H2,1-3H3,(H,24,26)