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propan-2-yl 4-[(4-methylsulfonyl-2-nitro-phenyl)amino]benzoate

propan-2-yl 4-[(4-methylsulfonyl-2-nitro-phenyl)amino]benzoate

Systemtic Name:propan-2-yl 4-[(4-methylsulfonyl-2-nitro-phenyl)amino]benzoate
Openeye Name:isopropyl 4-(4-methylsulfonyl-2-nitro-anilino)benzoate
CAS Name:4-(4-methylsulfonyl-2-nitroanilino)benzoic acid propan-2-yl ester
IUPAC Name:propan-2-yl 4-(4-methylsulfonyl-2-nitroanilino)benzoate
Traditional Name:4-(4-mesyl-2-nitro-anilino)benzoic acid isopropyl ester
Formula: C17H18N2O6S
MolecularWeight: 378.39962
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]


Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]


InChI

InChI=1S/C17H18N2O6S/c1-11(2)25-17(20)12-4-6-13(7-5-12)18-15-9-8-14(26(3,23)24)10-16(15)19(21)22/h4-11,18H,1-3H3


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