ethyl 3-[[3-acetamido-4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(3-ethoxy-3-oxidanylidene-propyl)amino]propanoate

Systemtic Name: ethyl 3-[[3-acetamido-4-[(2-chloranyl-4-nitro-phenyl)diazenyl]phenyl]-(3-ethoxy-3-oxidanylidene-propyl)amino]propanoate Openeye Name: ethyl 3-[3-acetamido-4-(2-chloro-4-nitro-phenyl)azo-N-(3-ethoxy-3-oxo-propyl)anilino]propanoate CAS Name: 3-[3-acetamido-4-(2-chloro-4-nitrophenyl)azo-N-(3-ethoxy-3-oxopropyl)anilino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-acetamido-4-[(2-chloro-4-nitrophenyl)diazenyl]-N-(3-ethoxy-3-oxopropyl)anilino]propanoate Traditional Name: 3-[3-acetamido-4-(2-chloro-4-nitro-phenyl)azo-N-(3-ethoxy-3-keto-propyl)anilino]propionic acid ethyl ester Formula: C24H28ClN5O7 MolecularWeight: 533.96142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CCC(=O)OCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C

Isomeric SMILES

CCOC(=O)CCN(CCC(=O)OCC)C1=CC(=C(C=C1)N=NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC(=O)C

InChI

InChI=1S/C24H28ClN5O7/c1-4-36-23(32)10-12-29(13-11-24(33)37-5-2)17-6-9-21(22(15-17)26-16(3)31)28-27-20-8-7-18(30(34)35)14-19(20)25/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,26,31)