methyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]benzoate Openeye Name: methyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]benzoate CAS Name: 4-[[2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-1-oxopentyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]benzoate Traditional Name: 4-[2-[(4-fluorobenzyl)carbamoylamino]pentanoylamino]benzoic acid methyl ester Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCCC(C(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C21H24FN3O4/c1-3-4-18(25-21(28)23-13-14-5-9-16(22)10-6-14)19(26)24-17-11-7-15(8-12-17)20(27)29-2/h5-12,18H,3-4,13H2,1-2H3,(H,24,26)(H2,23,25,28)