[1-[3-(cyclopropylcarbonylamino)phenyl]piperidin-4-yl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [1-[3-(cyclopropylcarbonylamino)phenyl]piperidin-4-yl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [1-[3-(cyclopropanecarbonylamino)phenyl]-4-piperidyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [1-[3-[[cyclopropyl(oxo)methyl]amino]phenyl]-4-piperidinyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [1-[3-(cyclopropanecarbonylamino)phenyl]piperidin-4-yl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [1-[3-(cyclopropanecarbonylamino)phenyl]-4-piperidyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C21H30N5O+ MolecularWeight: 368.4958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CCCN4C=CN=C4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)N3CCC(CC3)[NH2+]CCCN4C=CN=C4

InChI

InChI=1S/C21H29N5O/c27-21(17-5-6-17)24-19-3-1-4-20(15-19)26-12-7-18(8-13-26)23-9-2-11-25-14-10-22-16-25/h1,3-4,10,14-18,23H,2,5-9,11-13H2,(H,24,27)/p+1