2-[[4-[4-(2-acetyloxyethylamino)-3-nitro-phenyl]sulfonyl-2-nitro-phenyl]amino]ethyl ethanoate

Systemtic Name: 2-[[4-[4-(2-acetyloxyethylamino)-3-nitro-phenyl]sulfonyl-2-nitro-phenyl]amino]ethyl ethanoate Openeye Name: 2-[4-[4-(2-acetoxyethylamino)-3-nitro-phenyl]sulfonyl-2-nitro-anilino]ethyl acetate CAS Name: acetic acid 2-[4-[4-(2-acetyloxyethylamino)-3-nitrophenyl]sulfonyl-2-nitroanilino]ethyl ester IUPAC Name: 2-[4-[4-(2-acetyloxyethylamino)-3-nitrophenyl]sulfonyl-2-nitroanilino]ethyl acetate Traditional Name: acetic acid 2-[4-[4-(2-acetoxyethylamino)-3-nitro-phenyl]sulfonyl-2-nitro-anilino]ethyl ester Formula: C20H22N4O10S MolecularWeight: 510.47448

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCNC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)NCCOC(=O)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCNC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)NCCOC(=O)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O10S/c1-13(25)33-9-7-21-17-5-3-15(11-19(17)23(27)28)35(31,32)16-4-6-18(20(12-16)24(29)30)22-8-10-34-14(2)26/h3-6,11-12,21-22H,7-10H2,1-2H3