ethyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]piperidine-1-carboxylate CAS Name: 4-[[2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-1-oxopentyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]piperidine-1-carboxylate Traditional Name: 4-[2-[(4-fluorobenzyl)carbamoylamino]pentanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C21H31FN4O4 MolecularWeight: 422.493643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1CCN(CC1)C(=O)OCC)NC(=O)NCC2=CC=C(C=C2)F

Isomeric SMILES

CCCC(C(=O)NC1CCN(CC1)C(=O)OCC)NC(=O)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C21H31FN4O4/c1-3-5-18(25-20(28)23-14-15-6-8-16(22)9-7-15)19(27)24-17-10-12-26(13-11-17)21(29)30-4-2/h6-9,17-18H,3-5,10-14H2,1-2H3,(H,24,27)(H2,23,25,28)