2-chloranyl-N1-[2-(1-methyl-3H-pyrazol-2-yl)ethyl]-5-nitro-benzene-1,4-diamine

Systemtic Name: 2-chloranyl-N1-[2-(1-methyl-3H-pyrazol-2-yl)ethyl]-5-nitro-benzene-1,4-diamine Openeye Name: 2-chloro-N1-[2-(1-methyl-3H-pyrazol-2-yl)ethyl]-5-nitro-benzene-1,4-diamine CAS Name: 2-chloro-N1-[2-(1-methyl-3H-pyrazol-2-yl)ethyl]-5-nitrobenzene-1,4-diamine IUPAC Name: 2-chloro-1-N-[2-(1-methyl-3H-pyrazol-2-yl)ethyl]-5-nitrobenzene-1,4-diamine Traditional Name: (4-amino-2-chloro-5-nitro-phenyl)-[2-(2-methyl-3-pyrazolin-1-yl)ethyl]amine Formula: C12H16ClN5O2 MolecularWeight: 297.74074

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CCN1CCNC2=CC(=C(C=C2Cl)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=CCN1CCNC2=CC(=C(C=C2Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C12H16ClN5O2/c1-16-4-2-5-17(16)6-3-15-11-8-12(18(19)20)10(14)7-9(11)13/h2,4,7-8,15H,3,5-6,14H2,1H3