methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1-prop-2-ynylindol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1-prop-2-ynylindol-3-yl)propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(1-prop-2-ynylindol-3-yl)propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(1-prop-2-ynyl-3-indolyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1-prop-2-ynylindol-3-yl)propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(1-propargylindol-3-yl)propionic acid methyl ester Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CN(C2=CC=CC=C21)CC#C)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CN(C2=CC=CC=C21)CC#C)C(=O)OC

InChI

InChI=1S/C20H24N2O4/c1-6-11-22-13-14(15-9-7-8-10-17(15)22)12-16(18(23)25-5)21-19(24)26-20(2,3)4/h1,7-10,13,16H,11-12H2,2-5H3,(H,21,24)/t16-/m0/s1