2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)-5-(octanoylamino)benzamide

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)-5-(octanoylamino)benzamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholinopropyl)-5-(octanoylamino)benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-[3-(4-morpholinyl)propyl]-5-(1-oxooctylamino)benzamide IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)-5-(octanoylamino)benzamide Traditional Name: 5-(caprylylamino)-2-[4-(2-methoxyphenyl)piperazino]-N-(3-morpholinopropyl)benzamide Formula: C33H49N5O4 MolecularWeight: 579.77326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C33H49N5O4/c1-3-4-5-6-7-13-32(39)35-27-14-15-29(28(26-27)33(40)34-16-10-17-36-22-24-42-25-23-36)37-18-20-38(21-19-37)30-11-8-9-12-31(30)41-2/h8-9,11-12,14-15,26H,3-7,10,13,16-25H2,1-2H3,(H,34,40)(H,35,39)