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

Systemtic Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Openeye Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methyleneamino]benzamide CAS Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Traditional Name: 4-butoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methyleneamino]benzamide Formula: C30H32N4O3 MolecularWeight: 496.60008

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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)OCCC)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C30H32N4O3/c1-3-5-20-37-28-17-13-24(14-18-28)30(35)32-31-21-25-22-34(26-9-7-6-8-10-26)33-29(25)23-11-15-27(16-12-23)36-19-4-2/h6-18,21-22H,3-5,19-20H2,1-2H3,(H,32,35)/b31-21+