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

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-(4-methoxyanilino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-(1H-indol-3-yl)-1-(4-methoxyanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-(4-methoxyanilino)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-(p-anisidino)ethyl]ammonium Formula: C18H20N3O2+ MolecularWeight: 310.3703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(CC2=CNC3=CC=CC=C32)[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)[NH3+]

InChI

InChI=1S/C18H19N3O2/c1-23-14-8-6-13(7-9-14)21-18(22)16(19)10-12-11-20-17-5-3-2-4-15(12)17/h2-9,11,16,20H,10,19H2,1H3,(H,21,22)/p+1/t16-/m0/s1