ethyl 5-(4-aminophenyl)-1-(4-chloranyl-2-nitro-phenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-(4-aminophenyl)-1-(4-chloranyl-2-nitro-phenyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(4-aminophenyl)-1-(4-chloro-2-nitro-phenyl)triazole-4-carboxylate CAS Name: 5-(4-aminophenyl)-1-(4-chloro-2-nitrophenyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-aminophenyl)-1-(4-chloro-2-nitrophenyl)triazole-4-carboxylate Traditional Name: 5-(4-aminophenyl)-1-(4-chloro-2-nitro-phenyl)triazole-4-carboxylic acid ethyl ester Formula: C17H14ClN5O4 MolecularWeight: 387.77716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C3=CC=C(C=C3)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C3=CC=C(C=C3)N

InChI

InChI=1S/C17H14ClN5O4/c1-2-27-17(24)15-16(10-3-6-12(19)7-4-10)22(21-20-15)13-8-5-11(18)9-14(13)23(25)26/h3-9H,2,19H2,1H3