(3,4-dichlorophenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

Systemtic Name: (3,4-dichlorophenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Openeye Name: (3,4-dichlorophenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propanoic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propionic acid (3,4-dichlorobenzyl) ester Formula: C20H18Cl2N2O3 MolecularWeight: 405.27452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H18Cl2N2O3/c1-12(25)24-19(9-14-10-23-18-5-3-2-4-15(14)18)20(26)27-11-13-6-7-16(21)17(22)8-13/h2-8,10,19,23H,9,11H2,1H3,(H,24,25)/t19-/m0/s1