N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(4-morpholino-2,1,3-benzoxadiazol-7-yl)-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[4-(4-morpholinyl)-2,1,3-benzoxadiazol-7-yl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(7-morpholinobenzofurazan-4-yl)-3-(4-nitropyrazol-1-yl)propionamide Formula: C16H17N7O5 MolecularWeight: 387.35008

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C3=NON=C23)NC(=O)CCN4C=C(C=N4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C3=NON=C23)NC(=O)CCN4C=C(C=N4)[N+](=O)[O-]

InChI

InChI=1S/C16H17N7O5/c24-14(3-4-22-10-11(9-17-22)23(25)26)18-12-1-2-13(16-15(12)19-28-20-16)21-5-7-27-8-6-21/h1-2,9-10H,3-8H2,(H,18,24)