[(2S)-4-[1-(3-pyrazol-1-ylphenyl)piperidin-4-yl]morpholin-2-yl]methylazanium

Systemtic Name: [(2S)-4-[1-(3-pyrazol-1-ylphenyl)piperidin-4-yl]morpholin-2-yl]methylazanium Openeye Name: [(2S)-4-[1-(3-pyrazol-1-ylphenyl)-4-piperidyl]morpholin-2-yl]methylammonium CAS Name: [(2S)-4-[1-[3-(1-pyrazolyl)phenyl]-4-piperidinyl]-2-morpholinyl]methylammonium IUPAC Name: [(2S)-4-[1-(3-pyrazol-1-ylphenyl)piperidin-4-yl]morpholin-2-yl]methylazanium Traditional Name: [(2S)-4-[1-(3-pyrazol-1-ylphenyl)-4-piperidyl]morpholin-2-yl]methylammonium Formula: C19H28N5O+ MolecularWeight: 342.45852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCOC(C2)C[NH3+])C3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

C1CN(CCC1N2CCO[C@H](C2)C[NH3+])C3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C19H27N5O/c20-14-19-15-23(11-12-25-19)16-5-9-22(10-6-16)17-3-1-4-18(13-17)24-8-2-7-21-24/h1-4,7-8,13,16,19H,5-6,9-12,14-15,20H2/p+1/t19-/m0/s1