methyl 2-[1-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-(4-methoxy-3-morpholinosulfonyl-benzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-methoxy-3-morpholin-4-ylsulfonylbenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(4-methoxy-3-morpholinosulfonyl-benzoyl)piperazin-2-yl]acetic acid methyl ester Formula: C19H25N3O8S MolecularWeight: 455.4821

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCNC(=O)C2CC(=O)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H25N3O8S/c1-28-15-4-3-13(11-16(15)31(26,27)21-7-9-30-10-8-21)19(25)22-6-5-20-18(24)14(22)12-17(23)29-2/h3-4,11,14H,5-10,12H2,1-2H3,(H,20,24)