N-[(4-fluorophenyl)methyl]-5-(octanoylamino)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-(octanoylamino)-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[(4-fluorophenyl)methyl]-5-(octanoylamino)-2-pyrrolidin-1-yl-benzamide CAS Name: N-[(4-fluorophenyl)methyl]-5-(1-oxooctylamino)-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(4-fluorophenyl)methyl]-5-(octanoylamino)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-(caprylylamino)-N-(4-fluorobenzyl)-2-pyrrolidino-benzamide Formula: C26H34FN3O2 MolecularWeight: 439.565463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C26H34FN3O2/c1-2-3-4-5-6-9-25(31)29-22-14-15-24(30-16-7-8-17-30)23(18-22)26(32)28-19-20-10-12-21(27)13-11-20/h10-15,18H,2-9,16-17,19H2,1H3,(H,28,32)(H,29,31)