(2R)-4-(4-fluorophenyl)-2-[2-(1H-indol-3-yl)ethylazaniumyl]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-(4-fluorophenyl)-2-[2-(1H-indol-3-yl)ethylazaniumyl]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-fluorophenyl)-2-[2-(1H-indol-3-yl)ethylammonio]-4-oxo-butanoate CAS Name: (2R)-4-(4-fluorophenyl)-2-[2-(1H-indol-3-yl)ethylammonio]-4-oxobutanoate IUPAC Name: (2R)-4-(4-fluorophenyl)-2-[2-(1H-indol-3-yl)ethylazaniumyl]-4-oxobutanoate Traditional Name: (2R)-4-(4-fluorophenyl)-2-[2-(1H-indol-3-yl)ethylammonio]-4-keto-butyrate Formula: C20H19FN2O3 MolecularWeight: 354.374863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC[NH2+]C(CC(=O)C3=CC=C(C=C3)F)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC[NH2+][C@H](CC(=O)C3=CC=C(C=C3)F)C(=O)[O-]

InChI

InChI=1S/C20H19FN2O3/c21-15-7-5-13(6-8-15)19(24)11-18(20(25)26)22-10-9-14-12-23-17-4-2-1-3-16(14)17/h1-8,12,18,22-23H,9-11H2,(H,25,26)/t18-/m1/s1