2-[2-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]carbonylamino]ethanoylamino]propanoic acid

Systemtic Name: 2-[2-[[4-[(4-dimethylaminophenyl)diazenyl]phenyl]carbonylamino]ethanoylamino]propanoic acid Openeye Name: 2-[[2-[[4-(4-dimethylaminophenyl)azobenzoyl]amino]acetyl]amino]propanoic acid CAS Name: 2-[[2-[[[4-(4-dimethylaminophenyl)azophenyl]-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-[[4-[(4-dimethylaminophenyl)diazenyl]benzoyl]amino]acetyl]amino]propanoic acid Traditional Name: 2-[[2-[[4-(4-dimethylaminophenyl)azobenzoyl]amino]acetyl]amino]propionic acid Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CNC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C(=O)O)NC(=O)CNC(=O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H23N5O4/c1-13(20(28)29)22-18(26)12-21-19(27)14-4-6-15(7-5-14)23-24-16-8-10-17(11-9-16)25(2)3/h4-11,13H,12H2,1-3H3,(H,21,27)(H,22,26)(H,28,29)