[1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]-(2-pyridin-3-yloxyethyl)azanium

Systemtic Name: [1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]-(2-pyridin-3-yloxyethyl)azanium Openeye Name: [1-[4-(5-phenylpentanoylamino)phenyl]-4-piperidyl]-[2-(3-pyridyloxy)ethyl]ammonium CAS Name: [1-[4-[(1-oxo-5-phenylpentyl)amino]phenyl]-4-piperidinyl]-[2-(3-pyridinyloxy)ethyl]ammonium IUPAC Name: [1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]-(2-pyridin-3-yloxyethyl)azanium Traditional Name: [1-[4-(5-phenylpentanoylamino)phenyl]-4-piperidyl]-[2-(3-pyridyloxy)ethyl]ammonium Formula: C29H37N4O2+ MolecularWeight: 473.62968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCOC2=CN=CC=C2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1[NH2+]CCOC2=CN=CC=C2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4

InChI

InChI=1S/C29H36N4O2/c34-29(11-5-4-9-24-7-2-1-3-8-24)32-26-12-14-27(15-13-26)33-20-16-25(17-21-33)31-19-22-35-28-10-6-18-30-23-28/h1-3,6-8,10,12-15,18,23,25,31H,4-5,9,11,16-17,19-22H2,(H,32,34)/p+1