N-cyano-4-(phenylcarbonyl)-N'-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]piperazine-1-carboximidamide

Systemtic Name: N-cyano-4-(phenylcarbonyl)-N'-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]piperazine-1-carboximidamide Openeye Name: 4-benzoyl-N-cyano-N'-[3-[3-(1-piperidylmethyl)phenoxy]propyl]piperazine-1-carboxamidine CAS Name: 4-benzoyl-N-cyano-N'-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-1-piperazinecarboximidamide IUPAC Name: 4-benzoyl-N-cyano-N'-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]piperazine-1-carboximidamide Traditional Name: 4-benzoyl-N-cyano-N'-[3-[3-(piperidinomethyl)phenoxy]propyl]piperazine-1-carboxamidine Formula: C28H36N6O2 MolecularWeight: 488.62444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCN=C(NC#N)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCN=C(NC#N)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H36N6O2/c29-23-31-28(34-18-16-33(17-19-34)27(35)25-10-3-1-4-11-25)30-13-8-20-36-26-12-7-9-24(21-26)22-32-14-5-2-6-15-32/h1,3-4,7,9-12,21H,2,5-6,8,13-20,22H2,(H,30,31)