N-(4-bromanyl-2-methyl-phenyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-1-(1-oxo-3-phenylpropyl)-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-1-(3-phenylpropanoyl)piperidine-4-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-1-hydrocinnamoyl-isonipecotamide Formula: C22H25BrN2O2 MolecularWeight: 429.3501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2CCN(CC2)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2CCN(CC2)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C22H25BrN2O2/c1-16-15-19(23)8-9-20(16)24-22(27)18-11-13-25(14-12-18)21(26)10-7-17-5-3-2-4-6-17/h2-6,8-9,15,18H,7,10-14H2,1H3,(H,24,27)