[(2S)-1-[(4-fluorophenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-fluorophenyl)amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-(4-fluoroanilino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(4-fluoroanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-fluoroanilino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-(4-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=C(C=C3)F)[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)NC3=CC=C(C=C3)F)[NH3+]

InChI

InChI=1S/C17H16FN3O/c18-12-5-7-13(8-6-12)21-17(22)15(19)9-11-10-20-16-4-2-1-3-14(11)16/h1-8,10,15,20H,9,19H2,(H,21,22)/p+1/t15-/m0/s1