4-[4-imidazol-1-yl-6-[4-(4-nitrophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]morpholine

Systemtic Name: 4-[4-imidazol-1-yl-6-[4-(4-nitrophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]morpholine Openeye Name: 4-[4-imidazol-1-yl-6-[4-(4-nitrophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]morpholine CAS Name: 4-[4-(1-imidazolyl)-6-[4-(4-nitrophenyl)-1-piperazinyl]-1,3,5-triazin-2-yl]morpholine IUPAC Name: 4-[4-imidazol-1-yl-6-[4-(4-nitrophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]morpholine Traditional Name: 4-[4-imidazol-1-yl-6-[4-(4-nitrophenyl)piperazino]-s-triazin-2-yl]morpholine Formula: C20H23N9O3 MolecularWeight: 437.45512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=NC(=N3)N4C=CN=C4)N5CCOCC5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC(=NC(=N3)N4C=CN=C4)N5CCOCC5

InChI

InChI=1S/C20H23N9O3/c30-29(31)17-3-1-16(2-4-17)25-7-9-26(10-8-25)18-22-19(27-11-13-32-14-12-27)24-20(23-18)28-6-5-21-15-28/h1-6,15H,7-14H2