2-[(7-chloranyl-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl butanoate

Systemtic Name: 2-[(7-chloranyl-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl butanoate Openeye Name: 2-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl butanoate CAS Name: butanoic acid 2-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl ester IUPAC Name: 2-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl butanoate Traditional Name: butyric acid 2-[(7-chloro-4-nitro-benzofurazan-5-yl)amino]ethyl ester Formula: C12H13ClN4O5 MolecularWeight: 328.70842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCNC1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)OCCNC1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H13ClN4O5/c1-2-3-9(18)21-5-4-14-8-6-7(13)10-11(16-22-15-10)12(8)17(19)20/h6,14H,2-5H2,1H3