(2R)-3-(2-ethynyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: (2R)-3-(2-ethynyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: (2R)-2-(tert-butoxycarbonylamino)-3-(2-ethynyl-1H-indol-3-yl)propanoic acid CAS Name: (2R)-3-(2-ethynyl-1H-indol-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: (2R)-3-(2-ethynyl-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-(2-ethynyl-1H-indol-3-yl)propionic acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(NC2=CC=CC=C21)C#C)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=C(NC2=CC=CC=C21)C#C)C(=O)O

InChI

InChI=1S/C18H20N2O4/c1-5-13-12(11-8-6-7-9-14(11)19-13)10-15(16(21)22)20-17(23)24-18(2,3)4/h1,6-9,15,19H,10H2,2-4H3,(H,20,23)(H,21,22)/t15-/m1/s1