N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-1-phenyl-1,2,3,4-tetrazol-5-amine

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-1-phenyl-1,2,3,4-tetrazol-5-amine Openeye Name: N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-1-phenyl-tetrazol-5-amine CAS Name: N-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-1-phenyl-5-tetrazolamine IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-1-phenyltetrazol-5-amine Traditional Name: [(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-(1-phenyltetrazol-5-yl)amine Formula: C18H23N6O+ MolecularWeight: 339.41482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC2=NN=NN2C3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](CC1)[C@H](CNC2=NN=NN2C3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C18H22N6O/c1-3-8-15(9-4-1)24-18(20-21-22-24)19-14-16(17-10-7-13-25-17)23-11-5-2-6-12-23/h1,3-4,7-10,13,16H,2,5-6,11-12,14H2,(H,19,20,22)/p+1/t16-/m1/s1