(2S)-3-methyl-2-[(2-nitro-9H-fluoren-9-yl)methoxycarbonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(2-nitro-9H-fluoren-9-yl)methoxycarbonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[(2-nitro-9H-fluoren-9-yl)methoxycarbonylamino]butanoic acid CAS Name: (2S)-3-methyl-2-[[(2-nitro-9H-fluoren-9-yl)methoxy-oxomethyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[(2-nitro-9H-fluoren-9-yl)methoxycarbonylamino]butanoic acid Traditional Name: (2S)-3-methyl-2-[(2-nitro-9H-fluoren-9-yl)methoxycarbonylamino]butyric acid Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=C1C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=C1C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O6/c1-11(2)18(19(23)24)21-20(25)28-10-17-14-6-4-3-5-13(14)15-8-7-12(22(26)27)9-16(15)17/h3-9,11,17-18H,10H2,1-2H3,(H,21,25)(H,23,24)/t17?,18-/m0/s1