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

Systemtic Name: 5-(decanoylamino)-N-(2-morpholin-4-ylethyl)-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-(decanoylamino)-N-(2-morpholinoethyl)benzamide CAS Name: N-[2-(4-morpholinyl)ethyl]-5-(1-oxodecylamino)-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-(decanoylamino)-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 2-(4-benzylpiperazino)-5-(caprylamino)-N-(2-morpholinoethyl)benzamide Formula: C34H51N5O3 MolecularWeight: 577.80044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H51N5O3/c1-2-3-4-5-6-7-11-14-33(40)36-30-15-16-32(31(27-30)34(41)35-17-18-37-23-25-42-26-24-37)39-21-19-38(20-22-39)28-29-12-9-8-10-13-29/h8-10,12-13,15-16,27H,2-7,11,14,17-26,28H2,1H3,(H,35,41)(H,36,40)