methyl-[(3S)-1-(1,2-oxazol-3-ylmethyl)piperidin-3-yl]-phenethyl-azanium

Systemtic Name: methyl-[(3S)-1-(1,2-oxazol-3-ylmethyl)piperidin-3-yl]-phenethyl-azanium Openeye Name: [(3S)-1-(isoxazol-3-ylmethyl)-3-piperidyl]-methyl-phenethyl-ammonium CAS Name: [(3S)-1-(3-isoxazolylmethyl)-3-piperidinyl]-methyl-phenethylammonium IUPAC Name: methyl-[(3S)-1-(1,2-oxazol-3-ylmethyl)piperidin-3-yl]-phenethylazanium Traditional Name: [(3S)-1-(isoxazol-3-ylmethyl)-3-piperidyl]-methyl-phenethyl-ammonium Formula: C18H26N3O+ MolecularWeight: 300.41854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)CC3=NOC=C3

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)CC3=NOC=C3

InChI

InChI=1S/C18H25N3O/c1-20(12-9-16-6-3-2-4-7-16)18-8-5-11-21(15-18)14-17-10-13-22-19-17/h2-4,6-7,10,13,18H,5,8-9,11-12,14-15H2,1H3/p+1/t18-/m0/s1