[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate

Systemtic Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] (2S)-2-phenoxybutanoate Openeye Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl] (2S)-2-phenoxybutanoate CAS Name: (2S)-2-phenoxybutanoic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] (2S)-2-phenoxybutanoate Traditional Name: (2S)-2-phenoxybutyric acid [2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl] ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(=O)NCCC1=CNC2=CC=CC=C21)OC3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)OCC(=O)NCCC1=CNC2=CC=CC=C21)OC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4/c1-2-20(28-17-8-4-3-5-9-17)22(26)27-15-21(25)23-13-12-16-14-24-19-11-7-6-10-18(16)19/h3-11,14,20,24H,2,12-13,15H2,1H3,(H,23,25)/t20-/m0/s1