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

Systemtic Name: 1-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-[3-(dimethylamino)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Formula: C17H23ClN4O2 MolecularWeight: 350.84312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN(C)C)Cl

InChI

InChI=1S/C17H23ClN4O2/c1-13-11-14(5-6-15(13)18)24-12-22-10-7-16(20-22)17(23)19-8-4-9-21(2)3/h5-7,10-11H,4,8-9,12H2,1-3H3,(H,19,23)