methyl (2S,3S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2S,3S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-3-methyl-pentanoate Openeye Name: methyl (2S,3S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[[2-(4-fluorophenyl)ethylamino]-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-3-methyl-valeric acid methyl ester Formula: C16H23FN2O3 MolecularWeight: 310.363823

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)NCCC1=CC=C(C=C1)F

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC)NC(=O)NCCC1=CC=C(C=C1)F

InChI

InChI=1S/C16H23FN2O3/c1-4-11(2)14(15(20)22-3)19-16(21)18-10-9-12-5-7-13(17)8-6-12/h5-8,11,14H,4,9-10H2,1-3H3,(H2,18,19,21)/t11-,14-/m0/s1