N-[(E)-anthracen-9-ylmethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[(E)-anthracen-9-ylmethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-[(E)-9-anthrylmethyleneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide CAS Name: N-[(E)-9-anthracenylmethylideneamino]-1-[(4-nitrophenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[(E)-anthracen-9-ylmethylideneamino]-1-[(4-nitrophenyl)methyl]pyrazole-3-carboxamide Traditional Name: N-[(E)-9-anthrylmethyleneamino]-1-(4-nitrobenzyl)pyrazole-3-carboxamide Formula: C26H19N5O3 MolecularWeight: 449.46076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C=NNC(=O)C4=NN(C=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=N/NC(=O)C4=NN(C=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H19N5O3/c32-26(25-13-14-30(29-25)17-18-9-11-21(12-10-18)31(33)34)28-27-16-24-22-7-3-1-5-19(22)15-20-6-2-4-8-23(20)24/h1-16H,17H2,(H,28,32)/b27-16+