3-bromanyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]indole-1-carboxylic acid

Systemtic Name: 3-bromanyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]indole-1-carboxylic acid Openeye Name: 3-bromo-5-(tert-butoxycarbonylamino)indole-1-carboxylic acid CAS Name: 3-bromo-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-indolecarboxylic acid IUPAC Name: 3-bromo-5-[(2-methylpropan-2-yl)oxycarbonylamino]indole-1-carboxylic acid Traditional Name: 3-bromo-5-(tert-butoxycarbonylamino)indole-1-carboxylic acid Formula: C14H15BrN2O4 MolecularWeight: 355.1839

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)N(C=C2Br)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)N(C=C2Br)C(=O)O

InChI

InChI=1S/C14H15BrN2O4/c1-14(2,3)21-12(18)16-8-4-5-11-9(6-8)10(15)7-17(11)13(19)20/h4-7H,1-3H3,(H,16,18)(H,19,20)