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

Systemtic Name: 3-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Openeye Name: 3-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol CAS Name: 3-[[7-[2-(1-cyclohexenyl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]-1-propanol IUPAC Name: 3-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]propan-1-ol Traditional Name: 3-[[7-[2-(cyclohexen-1-yl)ethylamino]-4-nitro-benzofurazan-5-yl]amino]propan-1-ol Formula: C17H23N5O4 MolecularWeight: 361.39562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5O4/c23-10-4-8-18-14-11-13(19-9-7-12-5-2-1-3-6-12)15-16(21-26-20-15)17(14)22(24)25/h5,11,18-19,23H,1-4,6-10H2