3-azanyl-5-[5-[(2-chloranyl-4-nitro-phenyl)amino]pentyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[5-[(2-chloranyl-4-nitro-phenyl)amino]pentyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[5-(2-chloro-4-nitro-anilino)pentyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[5-(2-chloro-4-nitroanilino)pentyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[5-(2-chloro-4-nitroanilino)pentyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[5-(2-chloro-4-nitro-anilino)pentyl]-1H-pyrazole-4-carbonitrile Formula: C15H17ClN6O2 MolecularWeight: 348.78748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NCCCCCC2=C(C(=NN2)N)C#N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NCCCCCC2=C(C(=NN2)N)C#N

InChI

InChI=1S/C15H17ClN6O2/c16-12-8-10(22(23)24)5-6-14(12)19-7-3-1-2-4-13-11(9-17)15(18)21-20-13/h5-6,8,19H,1-4,7H2,(H3,18,20,21)