(4-nitrophenyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indole-2-carboxylate

Systemtic Name: (4-nitrophenyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indole-2-carboxylate Openeye Name: (4-nitrophenyl) 5-(tert-butoxycarbonylamino)-1H-indole-2-carboxylate CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1H-indole-2-carboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indole-2-carboxylate Traditional Name: 5-(tert-butoxycarbonylamino)-1H-indole-2-carboxylic acid (4-nitrophenyl) ester Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)NC(=C2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)NC(=C2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6/c1-20(2,3)29-19(25)21-13-4-9-16-12(10-13)11-17(22-16)18(24)28-15-7-5-14(6-8-15)23(26)27/h4-11,22H,1-3H3,(H,21,25)