[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propanoic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propionic acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H23N3O4 MolecularWeight: 357.40362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C

Isomeric SMILES

C[C@H](C(=O)NCC=C)OC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)C

InChI

InChI=1S/C19H23N3O4/c1-4-9-20-18(24)12(2)26-19(25)17(22-13(3)23)10-14-11-21-16-8-6-5-7-15(14)16/h4-8,11-12,17,21H,1,9-10H2,2-3H3,(H,20,24)(H,22,23)/t12-,17+/m1/s1