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

Systemtic Name: [(2S)-3-(1H-indol-3-yl)-1-[(2-methoxycarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-(1H-indol-3-ylmethyl)-2-(2-methoxycarbonylanilino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-3-(1H-indol-3-yl)-1-(2-methoxycarbonylanilino)-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-3-(1H-indol-3-yl)-1-(2-methoxycarbonylanilino)-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-(2-carbomethoxyanilino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]ammonium Formula: C19H20N3O3+ MolecularWeight: 338.3804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C(CC2=CNC3=CC=CC=C32)[NH3+]

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)[C@H](CC2=CNC3=CC=CC=C32)[NH3+]

InChI

InChI=1S/C19H19N3O3/c1-25-19(24)14-7-3-5-9-17(14)22-18(23)15(20)10-12-11-21-16-8-4-2-6-13(12)16/h2-9,11,15,21H,10,20H2,1H3,(H,22,23)/p+1/t15-/m0/s1