ethyl 3-(4-hydroxyphenyl)-2-[[2-nitro-4-(3-nitrophenyl)sulfonyl-phenyl]amino]propanoate

Systemtic Name: ethyl 3-(4-hydroxyphenyl)-2-[[2-nitro-4-(3-nitrophenyl)sulfonyl-phenyl]amino]propanoate Openeye Name: ethyl 3-(4-hydroxyphenyl)-2-[2-nitro-4-(3-nitrophenyl)sulfonyl-anilino]propanoate CAS Name: 3-(4-hydroxyphenyl)-2-[2-nitro-4-(3-nitrophenyl)sulfonylanilino]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-hydroxyphenyl)-2-[2-nitro-4-(3-nitrophenyl)sulfonylanilino]propanoate Traditional Name: 3-(4-hydroxyphenyl)-2-[2-nitro-4-(3-nitrophenyl)sulfonyl-anilino]propionic acid ethyl ester Formula: C23H21N3O9S MolecularWeight: 515.49254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)O)NC2=C(C=C(C=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)O)NC2=C(C=C(C=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O9S/c1-2-35-23(28)21(12-15-6-8-17(27)9-7-15)24-20-11-10-19(14-22(20)26(31)32)36(33,34)18-5-3-4-16(13-18)25(29)30/h3-11,13-14,21,24,27H,2,12H2,1H3