2-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol

Systemtic Name: 2-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Openeye Name: 2-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol CAS Name: 2-[[7-[2-(1-cyclohexenyl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol IUPAC Name: 2-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Traditional Name: 2-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-benzofurazan-5-yl]amino]ethanol Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCO

Isomeric SMILES

C1CCC(=CC1)CCNC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCO

InChI

InChI=1S/C16H21N5O4/c22-9-8-18-13-10-12(17-7-6-11-4-2-1-3-5-11)14-15(20-25-19-14)16(13)21(23)24/h4,10,17-18,22H,1-3,5-9H2