2-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]butanoylamino]benzamide; ethanedioic acid

Systemtic Name: 2-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]butanoylamino]benzamide; ethanedioic acid Openeye Name: 2-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]butanoylamino]benzamide; oxalic acid CAS Name: 2-[[2-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-1-oxobutyl]amino]benzamide; oxalic acid IUPAC Name: 2-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]butanoylamino]benzamide; oxalic acid Traditional Name: oxalic acid; 2-[2-(4-veratroylpiperazino)butanoylamino]benzamide Formula: C26H32N4O9 MolecularWeight: 544.55368

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)N)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)N)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H30N4O5.C2H2O4/c1-4-19(23(30)26-18-8-6-5-7-17(18)22(25)29)27-11-13-28(14-12-27)24(31)16-9-10-20(32-2)21(15-16)33-3;3-1(4)2(5)6/h5-10,15,19H,4,11-14H2,1-3H3,(H2,25,29)(H,26,30);(H,3,4)(H,5,6)