[(2S)-1-[butyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[butyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[butyl(methyl)amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[butyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[butyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[butyl(methyl)amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C(CC1=CNC2=CC=CC=C21)[NH3+]

Isomeric SMILES

CCCCN(C)C(=O)[C@H](CC1=CNC2=CC=CC=C21)[NH3+]

InChI

InChI=1S/C16H23N3O/c1-3-4-9-19(2)16(20)14(17)10-12-11-18-15-8-6-5-7-13(12)15/h5-8,11,14,18H,3-4,9-10,17H2,1-2H3/p+1/t14-/m0/s1