ethanedioic acid; 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide

Systemtic Name: ethanedioic acid; 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide Openeye Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(p-tolyl)propanamide; oxalic acid CAS Name: 2-[4-(3-methoxyphenyl)-1-piperazinyl]-N-(4-methylphenyl)propanamide; oxalic acid IUPAC Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-N-(4-methylphenyl)propanamide; oxalic acid Traditional Name: 2-[4-(3-methoxyphenyl)piperazino]-N-(p-tolyl)propionamide; oxalic acid Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=CC(=CC=C3)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=CC(=CC=C3)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27N3O2.C2H2O4/c1-16-7-9-18(10-8-16)22-21(25)17(2)23-11-13-24(14-12-23)19-5-4-6-20(15-19)26-3;3-1(4)2(5)6/h4-10,15,17H,11-14H2,1-3H3,(H,22,25);(H,3,4)(H,5,6)