5-(3,4-dimethylphenyl)-N-(3-methoxypropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-N-(3-methoxypropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-(3-methoxypropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-N-(3-methoxypropyl)-2-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-N-(3-methoxypropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-(3-methoxypropyl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCCCOC)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCCCOC)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H24N4O4/c1-15-8-9-17(12-16(15)2)20-14-21(22(27)23-10-5-11-30-3)25(24-20)18-6-4-7-19(13-18)26(28)29/h4,6-9,12-14H,5,10-11H2,1-3H3,(H,23,27)