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

Systemtic Name: (2R)-2-azaniumyl-5-[azanyl-(9H-fluoren-9-ylmethoxycarbonylamino)methylidene]azaniumyl-pentanoate Openeye Name: (2R)-5-[amino-(9H-fluoren-9-ylmethoxycarbonylamino)methylene]ammonio-2-azaniumyl-pentanoate CAS Name: (2R)-5-[amino-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]methylidene]ammonio-2-ammoniopentanoate IUPAC Name: (2R)-5-[amino-(9H-fluoren-9-ylmethoxycarbonylamino)methylidene]azaniumyl-2-azaniumylpentanoate Traditional Name: (2R)-5-[amino-(9H-fluoren-9-ylmethoxycarbonylamino)methylene]ammonio-2-ammonio-valerate Formula: C21H25N4O4+ MolecularWeight: 397.4476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(=[NH+]CCCC(C(=O)[O-])[NH3+])N

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(=[NH+]CCC[C@H](C(=O)[O-])[NH3+])N

InChI

InChI=1S/C21H24N4O4/c22-18(19(26)27)10-5-11-24-20(23)25-21(28)29-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17-18H,5,10-12,22H2,(H,26,27)(H3,23,24,25,28)/p+1/t18-/m1/s1