(E,5S)-6-(1H-indol-3-yl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-3-enoic acid

Systemtic Name: (E,5S)-6-(1H-indol-3-yl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-3-enoic acid Openeye Name: (E,5S)-5-(tert-butoxycarbonylamino)-6-(1H-indol-3-yl)hex-3-enoic acid CAS Name: (E,5S)-6-(1H-indol-3-yl)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-hexenoic acid IUPAC Name: (E,5S)-6-(1H-indol-3-yl)-5-[(2-methylpropan-2-yl)oxycarbonylamino]hex-3-enoic acid Traditional Name: (E,5S)-5-(tert-butoxycarbonylamino)-6-(1H-indol-3-yl)hex-3-enoic acid Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)/C=C/CC(=O)O

InChI

InChI=1S/C19H24N2O4/c1-19(2,3)25-18(24)21-14(7-6-10-17(22)23)11-13-12-20-16-9-5-4-8-15(13)16/h4-9,12,14,20H,10-11H2,1-3H3,(H,21,24)(H,22,23)/b7-6+/t14-/m1/s1