N2-[(E)-(2-methoxy-3-nitro-phenyl)methylideneamino]-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-[(E)-(2-methoxy-3-nitro-phenyl)methylideneamino]-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Openeye Name: N2-[(E)-(2-methoxy-3-nitro-phenyl)methyleneamino]-N4-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine CAS Name: N2-[(E)-(2-methoxy-3-nitrophenyl)methylideneamino]-N4-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-[(E)-(2-methoxy-3-nitrophenyl)methylideneamino]-4-N-phenyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Traditional Name: (4-anilino-6-pyrrolidino-s-triazin-2-yl)-[(E)-(2-methoxy-3-nitro-benzylidene)amino]amine Formula: C21H22N8O3 MolecularWeight: 434.45118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1[N+](=O)[O-])C=NNC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4

Isomeric SMILES

COC1=C(C=CC=C1[N+](=O)[O-])/C=N/NC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C21H22N8O3/c1-32-18-15(8-7-11-17(18)29(30)31)14-22-27-20-24-19(23-16-9-3-2-4-10-16)25-21(26-20)28-12-5-6-13-28/h2-4,7-11,14H,5-6,12-13H2,1H3,(H2,23,24,25,26,27)/b22-14+