[1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]piperidin-4-yl]-(2-pyridin-4-ylethyl)azanium

Systemtic Name: [1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]piperidin-4-yl]-(2-pyridin-4-ylethyl)azanium Openeye Name: [1-[4-(2-morpholinoethylcarbamoyl)phenyl]-4-piperidyl]-[2-(4-pyridyl)ethyl]ammonium CAS Name: [1-[4-[[2-(4-morpholinyl)ethylamino]-oxomethyl]phenyl]-4-piperidinyl]-(2-pyridin-4-ylethyl)ammonium IUPAC Name: [1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]piperidin-4-yl]-(2-pyridin-4-ylethyl)azanium Traditional Name: [1-[4-(2-morpholinoethylcarbamoyl)phenyl]-4-piperidyl]-[2-(4-pyridyl)ethyl]ammonium Formula: C25H36N5O2+ MolecularWeight: 438.58564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCC2=CC=NC=C2)C3=CC=C(C=C3)C(=O)NCCN4CCOCC4

Isomeric SMILES

C1CN(CCC1[NH2+]CCC2=CC=NC=C2)C3=CC=C(C=C3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C25H35N5O2/c31-25(28-13-16-29-17-19-32-20-18-29)22-1-3-24(4-2-22)30-14-8-23(9-15-30)27-12-7-21-5-10-26-11-6-21/h1-6,10-11,23,27H,7-9,12-20H2,(H,28,31)/p+1