methyl 3-[[5-acetamido-4-[(2,4-dinitrophenyl)diazenyl]-2-methoxy-phenyl]-(3-methoxy-3-oxidanylidene-propyl)amino]propanoate

Systemtic Name: methyl 3-[[5-acetamido-4-[(2,4-dinitrophenyl)diazenyl]-2-methoxy-phenyl]-(3-methoxy-3-oxidanylidene-propyl)amino]propanoate Openeye Name: methyl 3-[5-acetamido-4-(2,4-dinitrophenyl)azo-2-methoxy-N-(3-methoxy-3-oxo-propyl)anilino]propanoate CAS Name: 3-[5-acetamido-4-(2,4-dinitrophenyl)azo-2-methoxy-N-(3-methoxy-3-oxopropyl)anilino]propanoic acid methyl ester IUPAC Name: methyl 3-[5-acetamido-4-[(2,4-dinitrophenyl)diazenyl]-2-methoxy-N-(3-methoxy-3-oxopropyl)anilino]propanoate Traditional Name: 3-[5-acetamido-4-(2,4-dinitrophenyl)azo-N-(3-keto-3-methoxy-propyl)-2-methoxy-anilino]propionic acid methyl ester Formula: C23H26N6O10 MolecularWeight: 546.48674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCC(=O)OC)CCC(=O)OC

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])OC)N(CCC(=O)OC)CCC(=O)OC

InChI

InChI=1S/C23H26N6O10/c1-14(30)24-17-12-20(27(9-7-22(31)38-3)10-8-23(32)39-4)21(37-2)13-18(17)26-25-16-6-5-15(28(33)34)11-19(16)29(35)36/h5-6,11-13H,7-10H2,1-4H3,(H,24,30)