methyl (2S)-3-(1H-indol-3-yl)-2-(3-indol-1-ylpropanoylamino)propanoate

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-(3-indol-1-ylpropanoylamino)propanoate Openeye Name: methyl (2S)-3-(1H-indol-3-yl)-2-(3-indol-1-ylpropanoylamino)propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[3-(1-indolyl)-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-(3-indol-1-ylpropanoylamino)propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(3-indol-1-ylpropanoylamino)propionic acid methyl ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)CCN3C=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)CCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C23H23N3O3/c1-29-23(28)20(14-17-15-24-19-8-4-3-7-18(17)19)25-22(27)11-13-26-12-10-16-6-2-5-9-21(16)26/h2-10,12,15,20,24H,11,13-14H2,1H3,(H,25,27)/t20-/m0/s1