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

Systemtic Name: 3-methoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Openeye Name: 3-methoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methyleneamino]benzamide CAS Name: 3-methoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 3-methoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Traditional Name: 3-methoxy-N-[(E)-[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methyleneamino]benzamide Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(C=C2/C=N/NC(=O)C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3/c1-3-16-34-24-14-12-20(13-15-24)26-22(19-31(30-26)23-9-5-4-6-10-23)18-28-29-27(32)21-8-7-11-25(17-21)33-2/h4-15,17-19H,3,16H2,1-2H3,(H,29,32)/b28-18+