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

Systemtic Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] (2S)-2-(phenylcarbamoylamino)propanoate Openeye Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl] (2S)-2-(phenylcarbamoylamino)propanoate CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]propanoic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] (2S)-2-(phenylcarbamoylamino)propanoate Traditional Name: (2S)-2-(phenylcarbamoylamino)propionic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl] ester Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCCC1=CNC2=CC=CC=C21)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NCCC1=CNC2=CC=CC=C21)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O4/c1-15(25-22(29)26-17-7-3-2-4-8-17)21(28)30-14-20(27)23-12-11-16-13-24-19-10-6-5-9-18(16)19/h2-10,13,15,24H,11-12,14H2,1H3,(H,23,27)(H2,25,26,29)/t15-/m0/s1