methyl 3-[[1-[[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]methyl]cyclobutyl]carbamoylamino]benzoate

Systemtic Name: methyl 3-[[1-[[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]methyl]cyclobutyl]carbamoylamino]benzoate Openeye Name: methyl 3-[[1-[[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]methyl]cyclobutyl]carbamoylamino]benzoate CAS Name: 3-[[[[1-[[2-[(4-fluorophenyl)methyl]-1-pyrrolidinyl]methyl]cyclobutyl]amino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-[[2-[(4-fluorophenyl)methyl]pyrrolidin-1-yl]methyl]cyclobutyl]carbamoylamino]benzoate Traditional Name: 3-[[1-[[2-(4-fluorobenzyl)pyrrolidino]methyl]cyclobutyl]carbamoylamino]benzoic acid methyl ester Formula: C25H30FN3O3 MolecularWeight: 439.522403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)NC2(CCC2)CN3CCCC3CC4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)NC2(CCC2)CN3CCCC3CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H30FN3O3/c1-32-23(30)19-5-2-6-21(16-19)27-24(31)28-25(12-4-13-25)17-29-14-3-7-22(29)15-18-8-10-20(26)11-9-18/h2,5-6,8-11,16,22H,3-4,7,12-15,17H2,1H3,(H2,27,28,31)