methyl (2R,5S)-5-azanyl-2-[(4-fluorophenyl)methyl]-6-methyl-4-oxidanylidene-heptanoate; sulfuric acid

Systemtic Name: methyl (2R,5S)-5-azanyl-2-[(4-fluorophenyl)methyl]-6-methyl-4-oxidanylidene-heptanoate; sulfuric acid Openeye Name: methyl (2R,5S)-5-amino-2-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-heptanoate; sulfuric acid CAS Name: (2R,5S)-5-amino-2-[(4-fluorophenyl)methyl]-6-methyl-4-oxoheptanoic acid methyl ester; sulfuric acid IUPAC Name: methyl (2R,5S)-5-amino-2-[(4-fluorophenyl)methyl]-6-methyl-4-oxoheptanoate; sulfuric acid Traditional Name: (2R,5S)-5-amino-2-(4-fluorobenzyl)-4-keto-6-methyl-enanthic acid methyl ester; sulfuric acid Formula: C16H24FNO7S MolecularWeight: 393.427663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)CC(CC1=CC=C(C=C1)F)C(=O)OC)N.OS(=O)(=O)O

Isomeric SMILES

CC(C)[C@@H](C(=O)C[C@@H](CC1=CC=C(C=C1)F)C(=O)OC)N.OS(=O)(=O)O

InChI

InChI=1S/C16H22FNO3.H2O4S/c1-10(2)15(18)14(19)9-12(16(20)21-3)8-11-4-6-13(17)7-5-11;1-5(2,3)4/h4-7,10,12,15H,8-9,18H2,1-3H3;(H2,1,2,3,4)/t12-,15+;/m1./s1