2-acetamido-3-[3-[[[3-(diazanylmethylideneamino)phenyl]carbonylamino]methyl]phenyl]propanoic acid

Systemtic Name: 2-acetamido-3-[3-[[[3-(diazanylmethylideneamino)phenyl]carbonylamino]methyl]phenyl]propanoic acid Openeye Name: 2-acetamido-3-[3-[[[3-(hydrazinomethyleneamino)benzoyl]amino]methyl]phenyl]propanoic acid CAS Name: 2-acetamido-3-[3-[[[[3-(hydrazinylmethylideneamino)phenyl]-oxomethyl]amino]methyl]phenyl]propanoic acid IUPAC Name: 2-acetamido-3-[3-[[[3-(hydrazinylmethylideneamino)benzoyl]amino]methyl]phenyl]propanoic acid Traditional Name: 2-acetamido-3-[3-[[[3-(hydrazinomethyleneamino)benzoyl]amino]methyl]phenyl]propionic acid Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=CC=C1)CNC(=O)C2=CC(=CC=C2)N=CNN)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC(=CC=C1)CNC(=O)C2=CC(=CC=C2)N=CNN)C(=O)O

InChI

InChI=1S/C20H23N5O4/c1-13(26)25-18(20(28)29)9-14-4-2-5-15(8-14)11-22-19(27)16-6-3-7-17(10-16)23-12-24-21/h2-8,10,12,18H,9,11,21H2,1H3,(H,22,27)(H,23,24)(H,25,26)(H,28,29)