3,4,5-trimethoxy-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]benzamide Traditional Name: N-[4-(3-ketopiperazino)benzyl]-3,4,5-trimethoxy-benzamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C21H25N3O5/c1-27-17-10-15(11-18(28-2)20(17)29-3)21(26)23-12-14-4-6-16(7-5-14)24-9-8-22-19(25)13-24/h4-7,10-11H,8-9,12-13H2,1-3H3,(H,22,25)(H,23,26)