(2S)-5-[azanyl(nitramido)methylidene]azaniumyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoate

Systemtic Name: (2S)-5-[azanyl(nitramido)methylidene]azaniumyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoate Openeye Name: (2S)-5-[amino(nitramido)methylene]ammonio-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoate CAS Name: (2S)-5-[amino(nitramido)methylidene]ammonio-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]pentanoate IUPAC Name: (2S)-5-[amino(nitramido)methylidene]azaniumyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoate Traditional Name: (2S)-5-[amino(nitramido)methylene]ammonio-2-(9H-fluoren-9-ylmethoxycarbonylamino)valerate Formula: C21H23N5O6 MolecularWeight: 441.43722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O6/c22-20(25-26(30)31)23-11-5-10-18(19(27)28)24-21(29)32-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17-18H,5,10-12H2,(H,24,29)(H,27,28)(H3,22,23,25)/t18-/m0/s1