(2R)-4-[(4-fluorophenyl)amino]-2-(3-methylbutylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: (2R)-4-[(4-fluorophenyl)amino]-2-(3-methylbutylamino)-4-oxidanylidene-butanoic acid Openeye Name: (2R)-4-(4-fluoroanilino)-2-(isopentylamino)-4-oxo-butanoic acid CAS Name: (2R)-4-(4-fluoroanilino)-2-(3-methylbutylamino)-4-oxobutanoic acid IUPAC Name: (2R)-4-(4-fluoroanilino)-2-(3-methylbutylamino)-4-oxobutanoic acid Traditional Name: (2R)-4-(4-fluoroanilino)-2-(isoamylamino)-4-keto-butyric acid Formula: C15H21FN2O3 MolecularWeight: 296.337243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(CC(=O)NC1=CC=C(C=C1)F)C(=O)O

Isomeric SMILES

CC(C)CCN[C@H](CC(=O)NC1=CC=C(C=C1)F)C(=O)O

InChI

InChI=1S/C15H21FN2O3/c1-10(2)7-8-17-13(15(20)21)9-14(19)18-12-5-3-11(16)4-6-12/h3-6,10,13,17H,7-9H2,1-2H3,(H,18,19)(H,20,21)/t13-/m1/s1