phenethyl 2-[[(2S)-2-azanyl-5-(3-fluorophenyl)-4-oxidanylidene-pentanoyl]amino]ethanoate

Systemtic Name: phenethyl 2-[[(2S)-2-azanyl-5-(3-fluorophenyl)-4-oxidanylidene-pentanoyl]amino]ethanoate Openeye Name: phenethyl 2-[[(2S)-2-amino-5-(3-fluorophenyl)-4-oxo-pentanoyl]amino]acetate CAS Name: 2-[[(2S)-2-amino-5-(3-fluorophenyl)-1,4-dioxopentyl]amino]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[[(2S)-2-amino-5-(3-fluorophenyl)-4-oxopentanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-amino-5-(3-fluorophenyl)-4-keto-pentanoyl]amino]acetic acid phenethyl ester Formula: C21H23FN2O4 MolecularWeight: 386.416723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(=O)CNC(=O)C(CC(=O)CC2=CC(=CC=C2)F)N

Isomeric SMILES

C1=CC=C(C=C1)CCOC(=O)CNC(=O)[C@H](CC(=O)CC2=CC(=CC=C2)F)N

InChI

InChI=1S/C21H23FN2O4/c22-17-8-4-7-16(11-17)12-18(25)13-19(23)21(27)24-14-20(26)28-10-9-15-5-2-1-3-6-15/h1-8,11,19H,9-10,12-14,23H2,(H,24,27)/t19-/m0/s1