dipotassium 4-[[(2S)-3-(1H-indol-3-yl)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: dipotassium 4-[[(2S)-3-(1H-indol-3-yl)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: dipotassium 4-[[(1S)-1-(1H-indol-3-ylmethyl)-2-oxido-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: dipotassium 4-[[(2S)-3-(1H-indol-3-yl)-1-oxido-1-oxopropan-2-yl]amino]-4-oxobutanoate IUPAC Name: dipotassium 4-[[(2S)-3-(1H-indol-3-yl)-1-oxido-1-oxopropan-2-yl]amino]-4-oxobutanoate Traditional Name: dipotassium 4-[[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-oxido-ethyl]amino]-4-keto-butyrate Formula: C15H14K2N2O5 MolecularWeight: 380.47866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])NC(=O)CCC(=O)[O-].[K+].[K+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)[O-])NC(=O)CCC(=O)[O-].[K+].[K+]

InChI

InChI=1S/C15H16N2O5.2K/c18-13(5-6-14(19)20)17-12(15(21)22)7-9-8-16-11-4-2-1-3-10(9)11;;/h1-4,8,12,16H,5-7H2,(H,17,18)(H,19,20)(H,21,22);;/q;2*+1/p-2/t12-;;/m0../s1