N-[(2-chloranyl-5-nitro-phenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-1-(2-methoxyethyl)-4-pyrazolamine IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine Traditional Name: (2-chloro-5-nitro-benzyl)-[1-(2-methoxyethyl)pyrazol-4-yl]amine Formula: C13H15ClN4O3 MolecularWeight: 310.7362

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=C(C=N1)NCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COCCN1C=C(C=N1)NCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H15ClN4O3/c1-21-5-4-17-9-11(8-16-17)15-7-10-6-12(18(19)20)2-3-13(10)14/h2-3,6,8-9,15H,4-5,7H2,1H3