4-butoxy-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide

Systemtic Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Openeye Name: N-[(E)-[3-(4-benzyloxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-4-butoxy-benzamide CAS Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Traditional Name: N-[(E)-[3-(4-benzoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-4-butoxy-benzamide Formula: C34H32N4O3 MolecularWeight: 544.64288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NN=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N/N=C/C2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H32N4O3/c1-2-3-22-40-31-20-16-28(17-21-31)34(39)36-35-23-29-24-38(30-12-8-5-9-13-30)37-33(29)27-14-18-32(19-15-27)41-25-26-10-6-4-7-11-26/h4-21,23-24H,2-3,22,25H2,1H3,(H,36,39)/b35-23+