(2S)-6-[bis(azanyl)methylideneazaniumyl]-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoate

Systemtic Name: (2S)-6-[bis(azanyl)methylideneazaniumyl]-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoate Openeye Name: (2S)-6-(diaminomethyleneammonio)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoate CAS Name: (2S)-6-(diaminomethylideneammonio)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]hexanoate IUPAC Name: (2S)-6-(diaminomethylideneazaniumyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoate Traditional Name: (2S)-6-(diaminomethyleneammonio)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoate Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CCCC[NH+]=C(N)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCCC[NH+]=C(N)N)C(=O)[O-]

InChI

InChI=1S/C22H26N4O4/c23-21(24)25-12-6-5-11-19(20(27)28)26-22(29)30-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,26,29)(H,27,28)(H4,23,24,25)/t19-/m0/s1