3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propyl ethanoate

Systemtic Name: 3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propyl ethanoate Openeye Name: 3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propyl acetate CAS Name: acetic acid 3-[[4-nitro-7-(propylthio)-2,1,3-benzoxadiazol-5-yl]amino]propyl ester IUPAC Name: 3-[(4-nitro-7-propylsulfanyl-2,1,3-benzoxadiazol-5-yl)amino]propyl acetate Traditional Name: acetic acid 3-[[4-nitro-7-(propylthio)benzofurazan-5-yl]amino]propyl ester Formula: C14H18N4O5S MolecularWeight: 354.38152

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NCCCOC(=O)C

Isomeric SMILES

CCCSC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NCCCOC(=O)C

InChI

InChI=1S/C14H18N4O5S/c1-3-7-24-11-8-10(15-5-4-6-22-9(2)19)14(18(20)21)13-12(11)16-23-17-13/h8,15H,3-7H2,1-2H3