[(2S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[ethyl-[2-(4-pyridyl)ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[ethyl(2-pyridin-4-ylethyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[ethyl-[2-(4-pyridyl)ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CC=NC=C1)C(=O)C(CC2=CNC3=CC=CC=C32)[NH3+]

Isomeric SMILES

CCN(CCC1=CC=NC=C1)C(=O)[C@H](CC2=CNC3=CC=CC=C32)[NH3+]

InChI

InChI=1S/C20H24N4O/c1-2-24(12-9-15-7-10-22-11-8-15)20(25)18(21)13-16-14-23-19-6-4-3-5-17(16)19/h3-8,10-11,14,18,23H,2,9,12-13,21H2,1H3/p+1/t18-/m0/s1