ethanedioic acid; 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N,N-bis(phenylmethyl)propanamide

Systemtic Name: ethanedioic acid; 2-[4-(4-methoxyphenyl)piperazin-1-yl]-N,N-bis(phenylmethyl)propanamide Openeye Name: N,N-dibenzyl-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide; oxalic acid CAS Name: 2-[4-(4-methoxyphenyl)-1-piperazinyl]-N,N-bis(phenylmethyl)propanamide; oxalic acid IUPAC Name: N,N-dibenzyl-2-[4-(4-methoxyphenyl)piperazin-1-yl]propanamide; oxalic acid Traditional Name: N,N-dibenzyl-2-[4-(4-methoxyphenyl)piperazino]propionamide; oxalic acid Formula: C30H35N3O6 MolecularWeight: 533.6154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)N3CCN(CC3)C4=CC=C(C=C4)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)N3CCN(CC3)C4=CC=C(C=C4)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C28H33N3O2.C2H2O4/c1-23(29-17-19-30(20-18-29)26-13-15-27(33-2)16-14-26)28(32)31(21-24-9-5-3-6-10-24)22-25-11-7-4-8-12-25;3-1(4)2(5)6/h3-16,23H,17-22H2,1-2H3;(H,3,4)(H,5,6)