N-[2-(2,5-dihydropyrrol-1-yl)-5,5-dipropoxy-cycloheptyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-(2,5-dihydropyrrol-1-yl)-5,5-dipropoxy-cycloheptyl]-4-fluoranyl-benzamide Openeye Name: N-[2-(2,5-dihydropyrrol-1-yl)-5,5-dipropoxy-cycloheptyl]-4-fluoro-benzamide CAS Name: N-[2-(2,5-dihydropyrrol-1-yl)-5,5-dipropoxycycloheptyl]-4-fluorobenzamide IUPAC Name: N-[2-(2,5-dihydropyrrol-1-yl)-5,5-dipropoxycycloheptyl]-4-fluorobenzamide Traditional Name: N-[5,5-dipropoxy-2-(3-pyrrolin-1-yl)cycloheptyl]-4-fluoro-benzamide Formula: C24H35FN2O3 MolecularWeight: 418.544703

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1(CCC(C(CC1)N2CC=CC2)NC(=O)C3=CC=C(C=C3)F)OCCC

Isomeric SMILES

CCCOC1(CCC(C(CC1)N2CC=CC2)NC(=O)C3=CC=C(C=C3)F)OCCC

InChI

InChI=1S/C24H35FN2O3/c1-3-17-29-24(30-18-4-2)13-11-21(22(12-14-24)27-15-5-6-16-27)26-23(28)19-7-9-20(25)10-8-19/h5-10,21-22H,3-4,11-18H2,1-2H3,(H,26,28)