[(3S)-1-(cyclobutylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1H-indol-4-ylmethyl)azanium

Systemtic Name: [(3S)-1-(cyclobutylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-(1H-indol-4-ylmethyl)azanium Openeye Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxo-3-piperidyl]methyl-(1H-indol-4-ylmethyl)ammonium CAS Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl-(1H-indol-4-ylmethyl)ammonium IUPAC Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl-(1H-indol-4-ylmethyl)azanium Traditional Name: [(3S)-1-(cyclobutylmethyl)-3-hydroxy-2-keto-3-piperidyl]methyl-(1H-indol-4-ylmethyl)ammonium Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2CCCC(C2=O)(C[NH2+]CC3=C4C=CNC4=CC=C3)O

Isomeric SMILES

C1CC(C1)CN2CCC[C@@](C2=O)(C[NH2+]CC3=C4C=CNC4=CC=C3)O

InChI

InChI=1S/C20H27N3O2/c24-19-20(25,9-3-11-23(19)13-15-4-1-5-15)14-21-12-16-6-2-7-18-17(16)8-10-22-18/h2,6-8,10,15,21-22,25H,1,3-5,9,11-14H2/p+1/t20-/m0/s1