[(2S,3S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-[2-(1H-indol-3-yl)ethylamino]-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]-2-methyl-butyl]ammonium Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCC1=CNC2=CC=CC=C21)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCCC1=CNC2=CC=CC=C21)[NH3+]

InChI

InChI=1S/C16H23N3O/c1-3-11(2)15(17)16(20)18-9-8-12-10-19-14-7-5-4-6-13(12)14/h4-7,10-11,15,19H,3,8-9,17H2,1-2H3,(H,18,20)/p+1/t11-,15-/m0/s1