ethyl 2-[[methylsulfonyl-(4-nitro-2-phenoxy-phenyl)amino]methyl-(phenylcarbonyl)amino]ethanoate

Systemtic Name: ethyl 2-[[methylsulfonyl-(4-nitro-2-phenoxy-phenyl)amino]methyl-(phenylcarbonyl)amino]ethanoate Openeye Name: ethyl 2-[benzoyl-[(N-methylsulfonyl-4-nitro-2-phenoxy-anilino)methyl]amino]acetate CAS Name: 2-[benzoyl-[(N-methylsulfonyl-4-nitro-2-phenoxyanilino)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzoyl-[(N-methylsulfonyl-4-nitro-2-phenoxyanilino)methyl]amino]acetate Traditional Name: 2-[benzoyl-[(N-mesyl-4-nitro-2-phenoxy-anilino)methyl]amino]acetic acid ethyl ester Formula: C25H25N3O8S MolecularWeight: 527.5463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CN(C1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2)S(=O)(=O)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN(CN(C1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2)S(=O)(=O)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H25N3O8S/c1-3-35-24(29)17-26(25(30)19-10-6-4-7-11-19)18-27(37(2,33)34)22-15-14-20(28(31)32)16-23(22)36-21-12-8-5-9-13-21/h4-16H,3,17-18H2,1-2H3