N-(2-butoxy-5-methoxy-phenyl)-4-pyrazol-1-yl-benzamide

Systemtic Name: N-(2-butoxy-5-methoxy-phenyl)-4-pyrazol-1-yl-benzamide Openeye Name: N-(2-butoxy-5-methoxy-phenyl)-4-pyrazol-1-yl-benzamide CAS Name: N-(2-butoxy-5-methoxyphenyl)-4-(1-pyrazolyl)benzamide IUPAC Name: N-(2-butoxy-5-methoxyphenyl)-4-pyrazol-1-ylbenzamide Traditional Name: N-(2-butoxy-5-methoxy-phenyl)-4-pyrazol-1-yl-benzamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)OC)NC(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)OC)NC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C21H23N3O3/c1-3-4-14-27-20-11-10-18(26-2)15-19(20)23-21(25)16-6-8-17(9-7-16)24-13-5-12-22-24/h5-13,15H,3-4,14H2,1-2H3,(H,23,25)