2-(6-bromanyl-1-ethanoyl-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoic acid

Systemtic Name: 2-(6-bromanyl-1-ethanoyl-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoic acid Openeye Name: 2-(1-acetyl-6-bromo-indol-3-yl)-2-(tert-butoxycarbonylamino)acetic acid CAS Name: 2-(1-acetyl-6-bromo-3-indolyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid IUPAC Name: 2-(1-acetyl-6-bromoindol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid Traditional Name: 2-(1-acetyl-6-bromo-indol-3-yl)-2-(tert-butoxycarbonylamino)acetic acid Formula: C17H19BrN2O5 MolecularWeight: 411.24716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=C(C2=C1C=C(C=C2)Br)C(C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)N1C=C(C2=C1C=C(C=C2)Br)C(C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H19BrN2O5/c1-9(21)20-8-12(11-6-5-10(18)7-13(11)20)14(15(22)23)19-16(24)25-17(2,3)4/h5-8,14H,1-4H3,(H,19,24)(H,22,23)