(2-oxidanylidene-2-phenylazanyl-ethyl) (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Openeye Name: (2-anilino-2-oxo-ethyl) (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propionic acid (2-anilino-2-keto-ethyl) ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4/c1-14(25)23-19(11-15-12-22-18-10-6-5-9-17(15)18)21(27)28-13-20(26)24-16-7-3-2-4-8-16/h2-10,12,19,22H,11,13H2,1H3,(H,23,25)(H,24,26)/t19-/m0/s1