N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(4-phenyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-[(4-phenylpiperazin-1-yl)methyl]benzamide Traditional Name: 4-[(4-phenylpiperazino)methyl]-N-[(E)-piperonylideneamino]benzamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C(=O)NN=CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C(=O)N/N=C/C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O3/c31-26(28-27-17-21-8-11-24-25(16-21)33-19-32-24)22-9-6-20(7-10-22)18-29-12-14-30(15-13-29)23-4-2-1-3-5-23/h1-11,16-17H,12-15,18-19H2,(H,28,31)/b27-17+