5-(dodecanoylamino)-N-(2-morpholin-4-ylethyl)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide

Systemtic Name: 5-(dodecanoylamino)-N-(2-morpholin-4-ylethyl)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-(dodecanoylamino)-N-(2-morpholinoethyl)benzamide CAS Name: N-[2-(4-morpholinyl)ethyl]-5-(1-oxododecylamino)-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-(dodecanoylamino)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 2-(4-benzylpiperazino)-5-(lauroylamino)-N-(2-morpholinoethyl)benzamide Formula: C36H55N5O3 MolecularWeight: 605.8536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NCCN4CCOCC4

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C36H55N5O3/c1-2-3-4-5-6-7-8-9-13-16-35(42)38-32-17-18-34(33(29-32)36(43)37-19-20-39-25-27-44-28-26-39)41-23-21-40(22-24-41)30-31-14-11-10-12-15-31/h10-12,14-15,17-18,29H,2-9,13,16,19-28,30H2,1H3,(H,37,43)(H,38,42)