(3-methoxycarbonylphenyl)methyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3-methoxycarbonylphenyl)methyl 2-chloro-5-morpholinosulfonyl-benzoate CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)benzoic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 2-chloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-chloro-5-morpholinosulfonyl-benzoic acid (3-carbomethoxybenzyl) ester Formula: C20H20ClNO7S MolecularWeight: 453.8933

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C20H20ClNO7S/c1-27-19(23)15-4-2-3-14(11-15)13-29-20(24)17-12-16(5-6-18(17)21)30(25,26)22-7-9-28-10-8-22/h2-6,11-12H,7-10,13H2,1H3