ethyl-[(3S)-1-[3-(furan-2-yl)propanoyl]piperidin-3-yl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: ethyl-[(3S)-1-[3-(furan-2-yl)propanoyl]piperidin-3-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: ethyl-[(3S)-1-[3-(2-furyl)propanoyl]-3-piperidyl]-(4-pyridylmethyl)ammonium CAS Name: ethyl-[(3S)-1-[3-(2-furanyl)-1-oxopropyl]-3-piperidinyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: ethyl-[(3S)-1-[3-(furan-2-yl)propanoyl]piperidin-3-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: ethyl-[(3S)-1-[3-(2-furyl)propanoyl]-3-piperidyl]-(4-pyridylmethyl)ammonium Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=NC=C1)C2CCCN(C2)C(=O)CCC3=CC=CO3

Isomeric SMILES

CC[NH+](CC1=CC=NC=C1)[C@H]2CCCN(C2)C(=O)CCC3=CC=CO3

InChI

InChI=1S/C20H27N3O2/c1-2-22(15-17-9-11-21-12-10-17)18-5-3-13-23(16-18)20(24)8-7-19-6-4-14-25-19/h4,6,9-12,14,18H,2-3,5,7-8,13,15-16H2,1H3/p+1/t18-/m0/s1