methyl-phenethyl-[(3S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]azanium

Systemtic Name: methyl-phenethyl-[(3S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]azanium Openeye Name: methyl-phenethyl-[(3S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidyl]ammonium CAS Name: methyl-phenethyl-[(3S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidinyl]ammonium IUPAC Name: methyl-phenethyl-[(3S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]azanium Traditional Name: methyl-phenethyl-[(3S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidyl]ammonium Formula: C23H29N4O+ MolecularWeight: 377.50256

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)CC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)CC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N4O/c1-26(16-14-19-9-4-2-5-10-19)21-13-8-15-27(17-21)18-22-24-23(25-28-22)20-11-6-3-7-12-20/h2-7,9-12,21H,8,13-18H2,1H3/p+1/t21-/m0/s1