tert-butyl 3-[(3-chlorophenyl)carbonylamino]-5-nitro-indazole-1-carboxylate

Systemtic Name: tert-butyl 3-[(3-chlorophenyl)carbonylamino]-5-nitro-indazole-1-carboxylate Openeye Name: tert-butyl 3-[(3-chlorobenzoyl)amino]-5-nitro-indazole-1-carboxylate CAS Name: 3-[[(3-chlorophenyl)-oxomethyl]amino]-5-nitro-1-indazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(3-chlorobenzoyl)amino]-5-nitroindazole-1-carboxylate Traditional Name: 3-[(3-chlorobenzoyl)amino]-5-nitro-indazole-1-carboxylic acid tert-butyl ester Formula: C19H17ClN4O5 MolecularWeight: 416.81508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H17ClN4O5/c1-19(2,3)29-18(26)23-15-8-7-13(24(27)28)10-14(15)16(22-23)21-17(25)11-5-4-6-12(20)9-11/h4-10H,1-3H3,(H,21,22,25)