2-(4-decyl-5-morpholin-4-yl-4,5-dihydro-1,2,3-triazol-1-yl)-5-nitro-benzaldehyde

Systemtic Name: 2-(4-decyl-5-morpholin-4-yl-4,5-dihydro-1,2,3-triazol-1-yl)-5-nitro-benzaldehyde Openeye Name: 2-(4-decyl-5-morpholino-4,5-dihydrotriazol-1-yl)-5-nitro-benzaldehyde CAS Name: 2-[4-decyl-5-(4-morpholinyl)-4,5-dihydrotriazol-1-yl]-5-nitrobenzaldehyde IUPAC Name: 2-(4-decyl-5-morpholin-4-yl-4,5-dihydrotriazol-1-yl)-5-nitrobenzaldehyde Traditional Name: 2-(4-decyl-5-morpholino-4,5-dihydrotriazol-1-yl)-5-nitro-benzaldehyde Formula: C23H35N5O4 MolecularWeight: 445.5551

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1C(N(N=N1)C2=C(C=C(C=C2)[N+](=O)[O-])C=O)N3CCOCC3

Isomeric SMILES

CCCCCCCCCCC1C(N(N=N1)C2=C(C=C(C=C2)[N+](=O)[O-])C=O)N3CCOCC3

InChI

InChI=1S/C23H35N5O4/c1-2-3-4-5-6-7-8-9-10-21-23(26-13-15-32-16-14-26)27(25-24-21)22-12-11-20(28(30)31)17-19(22)18-29/h11-12,17-18,21,23H,2-10,13-16H2,1H3