1-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-(4-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-(4-nitrophenyl)pyrazole-3-carboxamide Formula: C18H15ClN4O4 MolecularWeight: 386.7891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClN4O4/c1-12-10-15(6-7-16(12)19)27-11-22-9-8-17(21-22)18(24)20-13-2-4-14(5-3-13)23(25)26/h2-10H,11H2,1H3,(H,20,24)