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

Systemtic Name: N-(4-acetamidophenyl)-1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(4-acetamidophenyl)-1-[(4-chloro-3-methylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-[(4-chloro-3-methylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carboxamide Formula: C20H19ClN4O3 MolecularWeight: 398.84286

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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)NC(=O)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)NC(=O)C)Cl

InChI

InChI=1S/C20H19ClN4O3/c1-13-11-17(7-8-18(13)21)28-12-25-10-9-19(24-25)20(27)23-16-5-3-15(4-6-16)22-14(2)26/h3-11H,12H2,1-2H3,(H,22,26)(H,23,27)