2-(cyclohexen-1-yl)ethyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium

Systemtic Name: 2-(cyclohexen-1-yl)ethyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Openeye Name: 2-(cyclohexen-1-yl)ethyl-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium CAS Name: 2-(1-cyclohexenyl)ethyl-[1-[4-[oxo-(3-pyridinylmethylamino)methyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-(cyclohexen-1-yl)ethyl-[1-[4-(pyridin-3-ylmethylcarbamoyl)phenyl]piperidin-4-yl]azanium Traditional Name: 2-(cyclohexen-1-yl)ethyl-[1-[4-(3-pyridylmethylcarbamoyl)phenyl]-4-piperidyl]ammonium Formula: C26H35N4O+ MolecularWeight: 419.5823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CC[NH2+]C2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCC(=CC1)CC[NH2+]C2CCN(CC2)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C26H34N4O/c31-26(29-20-22-7-4-15-27-19-22)23-8-10-25(11-9-23)30-17-13-24(14-18-30)28-16-12-21-5-2-1-3-6-21/h4-5,7-11,15,19,24,28H,1-3,6,12-14,16-18,20H2,(H,29,31)/p+1