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

Systemtic Name: ethanedioic acid; N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-3-phenyl-propanamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-3-phenyl-propanamide; oxalic acid CAS Name: N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-3-phenylpropanamide; oxalic acid IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-3-phenylpropanamide; oxalic acid Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]butyl]-3-phenyl-propionamide; oxalic acid Formula: C26H35N3O6 MolecularWeight: 485.5726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)CCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)CCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H33N3O2.C2H2O4/c1-29-23-12-6-5-11-22(23)27-19-17-26(18-20-27)16-8-7-15-25-24(28)14-13-21-9-3-2-4-10-21;3-1(4)2(5)6/h2-6,9-12H,7-8,13-20H2,1H3,(H,25,28);(H,3,4)(H,5,6)