N-butyl-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-butyl-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-butyl-1-[(4-isopropylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-butyl-1-[(4-propan-2-ylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-butyl-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-butyl-1-[(4-isopropylphenoxy)methyl]pyrazole-3-carboxamide Formula: C18H25N3O2 MolecularWeight: 315.41

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCCNC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C18H25N3O2/c1-4-5-11-19-18(22)17-10-12-21(20-17)13-23-16-8-6-15(7-9-16)14(2)3/h6-10,12,14H,4-5,11,13H2,1-3H3,(H,19,22)