N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]pentanamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(4-fluorobenzyl)carbamoylamino]valeramide Formula: C22H26FN3O4 MolecularWeight: 415.457943

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC2=C(C=C1)OCCCO2)NC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCCC(C(=O)NC1=CC2=C(C=C1)OCCCO2)NC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O4/c1-2-4-18(26-22(28)24-14-15-5-7-16(23)8-6-15)21(27)25-17-9-10-19-20(13-17)30-12-3-11-29-19/h5-10,13,18H,2-4,11-12,14H2,1H3,(H,25,27)(H2,24,26,28)