[1-[3-(cyclopropylcarbonylamino)phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: [1-[3-(cyclopropylcarbonylamino)phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Openeye Name: [1-[3-(cyclopropanecarbonylamino)phenyl]-4-piperidyl]-(3-pyridylmethyl)ammonium CAS Name: [1-[3-[[cyclopropyl(oxo)methyl]amino]phenyl]-4-piperidinyl]-(3-pyridinylmethyl)ammonium IUPAC Name: [1-[3-(cyclopropanecarbonylamino)phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Traditional Name: [1-[3-(cyclopropanecarbonylamino)phenyl]-4-piperidyl]-(3-pyridylmethyl)ammonium Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CC4=CN=CC=C4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CC4=CN=CC=C4

InChI

InChI=1S/C21H26N4O/c26-21(17-6-7-17)24-19-4-1-5-20(13-19)25-11-8-18(9-12-25)23-15-16-3-2-10-22-14-16/h1-5,10,13-14,17-18,23H,6-9,11-12,15H2,(H,24,26)/p+1