N-[(E)-1-naphthalen-1-ylethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-1-naphthalen-1-ylethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-1-(1-naphthyl)ethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-1-(1-naphthalenyl)ethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-1-naphthalen-1-ylethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-1-(1-naphthyl)ethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=NN1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=NN1)C2=CC(=CC=C2)[N+](=O)[O-])/C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H17N5O3/c1-14(18-11-5-7-15-6-2-3-10-19(15)18)23-26-22(28)21-13-20(24-25-21)16-8-4-9-17(12-16)27(29)30/h2-13H,1H3,(H,24,25)(H,26,28)/b23-14+