3-(3-chlorophenyl)-N-[2-[(2-nitrophenyl)amino]ethyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(3-chlorophenyl)-N-[2-[(2-nitrophenyl)amino]ethyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(3-chlorophenyl)-N-[2-(2-nitroanilino)ethyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(3-chlorophenyl)-N-[2-(2-nitroanilino)ethyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(3-chlorophenyl)-N-[2-(2-nitroanilino)ethyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(3-chlorophenyl)-N-[2-(2-nitroanilino)ethyl]-1H-pyrazole-5-carboxamide Formula: C18H16ClN5O3 MolecularWeight: 385.80434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCCNC(=O)C2=CC(=NN2)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NCCNC(=O)C2=CC(=NN2)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClN5O3/c19-13-5-3-4-12(10-13)15-11-16(23-22-15)18(25)21-9-8-20-14-6-1-2-7-17(14)24(26)27/h1-7,10-11,20H,8-9H2,(H,21,25)(H,22,23)