[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [(1R)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [(1R)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]-methyl-(3-thenyl)ammonium Formula: C17H19N2OS+ MolecularWeight: 299.41056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+](C)CC3=CSC=C3

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)[NH+](C)CC3=CSC=C3

InChI

InChI=1S/C17H18N2OS/c1-12(19(2)10-13-7-8-21-11-13)17(20)15-9-18-16-6-4-3-5-14(15)16/h3-9,11-12,18H,10H2,1-2H3/p+1/t12-/m1/s1