N-[(4-chlorophenyl)methyl]-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-(3-pyrrol-1-yl-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-[3-(1-pyrrolyl)-2-pyridinyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(3-pyrrol-1-ylpyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-(3-pyrrol-1-yl-2-pyridyl)isonipecotamide Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)Cl)C3=C(C=CC=N3)N4C=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)Cl)C3=C(C=CC=N3)N4C=CC=C4

InChI

InChI=1S/C22H23ClN4O/c23-19-7-5-17(6-8-19)16-25-22(28)18-9-14-27(15-10-18)21-20(4-3-11-24-21)26-12-1-2-13-26/h1-8,11-13,18H,9-10,14-16H2,(H,25,28)