methyl (2S)-2-acetamido-3-[4-[5-[(2S)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]-2-nitro-phenoxy]phenyl]propanoate

Systemtic Name: methyl (2S)-2-acetamido-3-[4-[5-[(2S)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]-2-nitro-phenoxy]phenyl]propanoate Openeye Name: methyl (2S)-2-acetamido-3-[4-[5-[(2S)-2-acetamido-3-methoxy-3-oxo-propyl]-2-nitro-phenoxy]phenyl]propanoate CAS Name: (2S)-2-acetamido-3-[4-[5-[(2S)-2-acetamido-3-methoxy-3-oxopropyl]-2-nitrophenoxy]phenyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-[4-[5-[(2S)-2-acetamido-3-methoxy-3-oxopropyl]-2-nitrophenoxy]phenyl]propanoate Traditional Name: (2S)-2-acetamido-3-[4-[5-[(2S)-2-acetamido-3-keto-3-methoxy-propyl]-2-nitro-phenoxy]phenyl]propionic acid methyl ester Formula: C24H27N3O9 MolecularWeight: 501.48588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)OC2=C(C=CC(=C2)CC(C(=O)OC)NC(=O)C)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=C(C=C1)OC2=C(C=CC(=C2)C[C@@H](C(=O)OC)NC(=O)C)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C24H27N3O9/c1-14(28)25-19(23(30)34-3)11-16-5-8-18(9-6-16)36-22-13-17(7-10-21(22)27(32)33)12-20(24(31)35-4)26-15(2)29/h5-10,13,19-20H,11-12H2,1-4H3,(H,25,28)(H,26,29)/t19-,20-/m0/s1