methyl 2-[[4-(4-fluorophenyl)piperazin-1-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[4-(4-fluorophenyl)piperazin-1-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-4-methyl-pentanoate CAS Name: 2-[[[4-(4-fluorophenyl)-1-piperazinyl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-4-methylpentanoate Traditional Name: 2-[[4-(4-fluorophenyl)piperazine-1-carbonyl]amino]-4-methyl-valeric acid methyl ester Formula: C18H26FN3O3 MolecularWeight: 351.415743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H26FN3O3/c1-13(2)12-16(17(23)25-3)20-18(24)22-10-8-21(9-11-22)15-6-4-14(19)5-7-15/h4-7,13,16H,8-12H2,1-3H3,(H,20,24)