[(2S)-1-[(2-fluorophenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(2-fluorophenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-(2-fluoroanilino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(2-fluoroanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-(2-fluoroanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-(2-fluoroanilino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C17H17FN3O+ MolecularWeight: 298.334783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NC3=CC=CC=C3F)[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)NC3=CC=CC=C3F)[NH3+]

InChI

InChI=1S/C17H16FN3O/c18-13-6-2-4-8-16(13)21-17(22)14(19)9-11-10-20-15-7-3-1-5-12(11)15/h1-8,10,14,20H,9,19H2,(H,21,22)/p+1/t14-/m0/s1