N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-morpholino-5-nitro-benzamide Formula: C19H17ClN6O4 MolecularWeight: 428.82908

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

InChI

InChI=1S/C19H17ClN6O4/c20-13-1-3-18(25-12-21-11-22-25)16(9-13)23-19(27)15-10-14(26(28)29)2-4-17(15)24-5-7-30-8-6-24/h1-4,9-12H,5-8H2,(H,23,27)