2-[6-bromanyl-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-bromanyl-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]ethanoic acid Openeye Name: 2-(6-bromo-1-tert-butoxycarbonyl-2-methyl-indol-3-yl)acetic acid CAS Name: 2-[6-bromo-2-methyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-indolyl]acetic acid IUPAC Name: 2-[6-bromo-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]acetic acid Traditional Name: 2-(6-bromo-1-tert-butoxycarbonyl-2-methyl-indol-3-yl)acetic acid Formula: C16H18BrNO4 MolecularWeight: 368.22242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)OC(C)(C)C)C=C(C=C2)Br)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)OC(C)(C)C)C=C(C=C2)Br)CC(=O)O

InChI

InChI=1S/C16H18BrNO4/c1-9-12(8-14(19)20)11-6-5-10(17)7-13(11)18(9)15(21)22-16(2,3)4/h5-7H,8H2,1-4H3,(H,19,20)