5-(2-ethylhexanoylamino)-N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-(2-ethylhexanoylamino)-N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-(2-ethylhexanoylamino)-N-(2-morpholinoethyl)-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[(2-ethyl-1-oxohexyl)amino]-N-[2-(4-morpholinyl)ethyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-(2-ethylhexanoylamino)-N-(2-morpholin-4-ylethyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-(2-ethylhexanoylamino)-N-(2-morpholinoethyl)-2-pyrrolidino-benzamide Formula: C25H40N4O3 MolecularWeight: 444.6101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCCN3CCOCC3

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCCN3CCOCC3

InChI

InChI=1S/C25H40N4O3/c1-3-5-8-20(4-2)24(30)27-21-9-10-23(29-12-6-7-13-29)22(19-21)25(31)26-11-14-28-15-17-32-18-16-28/h9-10,19-20H,3-8,11-18H2,1-2H3,(H,26,31)(H,27,30)