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

Systemtic Name: 2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate Openeye Name: 2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid 2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl ester IUPAC Name: 2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid 2-[(4-nitrobenzofurazan-5-yl)amino]ethyl ester Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCCNC2=C(C3=NON=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCCNC2=C(C3=NON=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6/c1-2-10-26-13-5-3-12(4-6-13)18(23)27-11-9-19-15-8-7-14-16(21-28-20-14)17(15)22(24)25/h3-8,19H,2,9-11H2,1H3