N-(3-acetamido-4-methoxy-phenyl)-1-(4-bromophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-acetamido-4-methoxy-phenyl)-1-(4-bromophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-acetamido-4-methoxy-phenyl)-1-(4-bromobenzoyl)piperidine-4-carboxamide CAS Name: N-(3-acetamido-4-methoxyphenyl)-1-[(4-bromophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-acetamido-4-methoxyphenyl)-1-(4-bromobenzoyl)piperidine-4-carboxamide Traditional Name: N-(3-acetamido-4-methoxy-phenyl)-1-(4-bromobenzoyl)isonipecotamide Formula: C22H24BrN3O4 MolecularWeight: 474.34766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C22H24BrN3O4/c1-14(27)24-19-13-18(7-8-20(19)30-2)25-21(28)15-9-11-26(12-10-15)22(29)16-3-5-17(23)6-4-16/h3-8,13,15H,9-12H2,1-2H3,(H,24,27)(H,25,28)