phenyl N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(prop-2-ynylamino)propan-2-yl]carbamate

Systemtic Name: phenyl N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(prop-2-ynylamino)propan-2-yl]carbamate Openeye Name: phenyl N-[(1R)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(prop-2-ynylamino)ethyl]carbamate CAS Name: N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-(prop-2-ynylamino)propan-2-yl]carbamic acid phenyl ester IUPAC Name: phenyl N-[(2R)-3-(1H-indol-3-yl)-1-oxo-1-(prop-2-ynylamino)propan-2-yl]carbamate Traditional Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-keto-2-(propargylamino)ethyl]carbamic acid phenyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)OC3=CC=CC=C3

Isomeric SMILES

C#CCNC(=O)[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O3/c1-2-12-22-20(25)19(24-21(26)27-16-8-4-3-5-9-16)13-15-14-23-18-11-7-6-10-17(15)18/h1,3-11,14,19,23H,12-13H2,(H,22,25)(H,24,26)/t19-/m1/s1