[(2S)-3-(1H-indol-3-yl)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[2-(1H-indol-3-yl)ethylamino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-(1H-indol-3-yl)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[2-(1H-indol-3-yl)ethylamino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C21H23N4O+ MolecularWeight: 347.43352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C(CC3=CNC4=CC=CC=C43)[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)[C@H](CC3=CNC4=CC=CC=C43)[NH3+]

InChI

InChI=1S/C21H22N4O/c22-18(11-15-13-25-20-8-4-2-6-17(15)20)21(26)23-10-9-14-12-24-19-7-3-1-5-16(14)19/h1-8,12-13,18,24-25H,9-11,22H2,(H,23,26)/p+1/t18-/m0/s1