N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-chlorobenzyl)pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C16H15ClN6O3 MolecularWeight: 374.7817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClN6O3/c17-15-4-2-1-3-12(15)9-22-10-13(7-18-22)20-16(24)5-6-21-11-14(8-19-21)23(25)26/h1-4,7-8,10-11H,5-6,9H2,(H,20,24)