1-[2-acetamido-4-(1-acetyloxyethyl)-6-azanyl-3-[(2-bromanyl-4,6-dinitro-phenyl)diazenyl]-5-methoxy-phenyl]ethyl ethanoate

Systemtic Name: 1-[2-acetamido-4-(1-acetyloxyethyl)-6-azanyl-3-[(2-bromanyl-4,6-dinitro-phenyl)diazenyl]-5-methoxy-phenyl]ethyl ethanoate Openeye Name: 1-[2-acetamido-4-(1-acetoxyethyl)-6-amino-3-(2-bromo-4,6-dinitro-phenyl)azo-5-methoxy-phenyl]ethyl acetate CAS Name: acetic acid 1-[2-acetamido-4-(1-acetyloxyethyl)-6-amino-3-(2-bromo-4,6-dinitrophenyl)azo-5-methoxyphenyl]ethyl ester IUPAC Name: 1-[2-acetamido-4-(1-acetyloxyethyl)-6-amino-3-[(2-bromo-4,6-dinitrophenyl)diazenyl]-5-methoxyphenyl]ethyl acetate Traditional Name: acetic acid 1-[2-acetamido-4-(1-acetoxyethyl)-6-amino-3-(2-bromo-4,6-dinitro-phenyl)azo-5-methoxy-phenyl]ethyl ester Formula: C23H25BrN6O10 MolecularWeight: 625.3828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=C(C(=C1N)OC)C(C)OC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C)OC(=O)C

Isomeric SMILES

CC(C1=C(C(=C(C(=C1N)OC)C(C)OC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C)OC(=O)C

InChI

InChI=1S/C23H25BrN6O10/c1-9(39-12(4)32)17-19(25)23(38-6)18(10(2)40-13(5)33)22(21(17)26-11(3)31)28-27-20-15(24)7-14(29(34)35)8-16(20)30(36)37/h7-10H,25H2,1-6H3,(H,26,31)