ethanedioic acid; N-(4-morpholin-4-ylphenyl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide

Systemtic Name: ethanedioic acid; N-(4-morpholin-4-ylphenyl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide Openeye Name: N-(4-morpholinophenyl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide; oxalic acid CAS Name: N-[4-(4-morpholinyl)phenyl]-2-[4-(2-phenoxyethyl)-1-piperazinyl]propanamide; oxalic acid IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide; oxalic acid Traditional Name: N-(4-morpholinophenyl)-2-[4-(2-phenoxyethyl)piperazino]propionamide; oxalic acid Formula: C27H36N4O7 MolecularWeight: 528.59734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)N3CCN(CC3)CCOC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)N3CCN(CC3)CCOC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H34N4O3.C2H2O4/c1-21(25(30)26-22-7-9-23(10-8-22)29-16-18-31-19-17-29)28-13-11-27(12-14-28)15-20-32-24-5-3-2-4-6-24;3-1(4)2(5)6/h2-10,21H,11-20H2,1H3,(H,26,30);(H,3,4)(H,5,6)