aminocarbonyl-cyclopropyl-(1-propylpiperidin-4-yl)-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]azanium

Systemtic Name: aminocarbonyl-cyclopropyl-(1-propylpiperidin-4-yl)-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]azanium Openeye Name: carbamoyl-cyclopropyl-(1-propyl-4-piperidyl)-[2-(3-pyridylmethylcarbamoyl)phenyl]ammonium CAS Name: carbamoyl-cyclopropyl-[2-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-(1-propyl-4-piperidinyl)ammonium IUPAC Name: carbamoyl-cyclopropyl-(1-propylpiperidin-4-yl)-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]azanium Traditional Name: carbamoyl-cyclopropyl-(1-propyl-4-piperidyl)-[2-(3-pyridylmethylcarbamoyl)phenyl]ammonium Formula: C25H34N5O2+ MolecularWeight: 436.56976

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)[N+](C2CC2)(C3=CC=CC=C3C(=O)NCC4=CN=CC=C4)C(=O)N

Isomeric SMILES

CCCN1CCC(CC1)[N+](C2CC2)(C3=CC=CC=C3C(=O)NCC4=CN=CC=C4)C(=O)N

InChI

InChI=1S/C25H33N5O2/c1-2-14-29-15-11-21(12-16-29)30(25(26)32,20-9-10-20)23-8-4-3-7-22(23)24(31)28-18-19-6-5-13-27-17-19/h3-8,13,17,20-21H,2,9-12,14-16,18H2,1H3,(H2-,26,28,31,32)/p+1