N-[(E)-(3-nitrophenyl)methylideneamino]-3-(2-propoxyphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(3-nitrophenyl)methylideneamino]-3-(2-propoxyphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-(3-nitrophenyl)methyleneamino]-3-(2-propoxyphenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-(3-nitrophenyl)methylideneamino]-3-(2-propoxyphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-(3-nitrophenyl)methylideneamino]-3-(2-propoxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-(3-nitrobenzylidene)amino]-3-(2-propoxyphenyl)-1H-pyrazole-5-carboxamide Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NNC(=C2)C(=O)N/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4/c1-2-10-29-19-9-4-3-8-16(19)17-12-18(23-22-17)20(26)24-21-13-14-6-5-7-15(11-14)25(27)28/h3-9,11-13H,2,10H2,1H3,(H,22,23)(H,24,26)/b21-13+