4-chloranyl-N1,N3-bis[3-(3-methyl-2H-imidazol-1-yl)propyl]-6-nitro-benzene-1,3-diamine

Systemtic Name: 4-chloranyl-N1,N3-bis[3-(3-methyl-2H-imidazol-1-yl)propyl]-6-nitro-benzene-1,3-diamine Openeye Name: 4-chloro-N1,N3-bis[3-(3-methyl-2H-imidazol-1-yl)propyl]-6-nitro-benzene-1,3-diamine CAS Name: 4-chloro-N1,N3-bis[3-(3-methyl-2H-imidazol-1-yl)propyl]-6-nitrobenzene-1,3-diamine IUPAC Name: 4-chloro-1-N,3-N-bis[3-(3-methyl-2H-imidazol-1-yl)propyl]-6-nitrobenzene-1,3-diamine Traditional Name: [2-chloro-5-[3-(3-methyl-4-imidazolin-1-yl)propylamino]-4-nitro-phenyl]-[3-(3-methyl-4-imidazolin-1-yl)propyl]amine Formula: C20H30ClN7O2 MolecularWeight: 435.9509

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C=C1)CCCNC2=CC(=C(C=C2[N+](=O)[O-])Cl)NCCCN3CN(C=C3)C

Isomeric SMILES

CN1CN(C=C1)CCCNC2=CC(=C(C=C2[N+](=O)[O-])Cl)NCCCN3CN(C=C3)C

InChI

InChI=1S/C20H30ClN7O2/c1-24-9-11-26(15-24)7-3-5-22-18-14-19(20(28(29)30)13-17(18)21)23-6-4-8-27-12-10-25(2)16-27/h9-14,22-23H,3-8,15-16H2,1-2H3