methyl 5-[4-[2-methoxy-5-[methyl(phenethyl)sulfamoyl]phenyl]piperazin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[4-[2-methoxy-5-[methyl(phenethyl)sulfamoyl]phenyl]piperazin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[4-[2-methoxy-5-[methyl(phenethyl)sulfamoyl]phenyl]piperazin-1-yl]-5-oxo-pentanoate CAS Name: 5-[4-[2-methoxy-5-[methyl(phenethyl)sulfamoyl]phenyl]-1-piperazinyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[4-[2-methoxy-5-[methyl(phenethyl)sulfamoyl]phenyl]piperazin-1-yl]-5-oxopentanoate Traditional Name: 5-keto-5-[4-[2-methoxy-5-[methyl(phenethyl)sulfamoyl]phenyl]piperazino]valeric acid methyl ester Formula: C26H35N3O6S MolecularWeight: 517.6376

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)CCCC(=O)OC

Isomeric SMILES

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)CCCC(=O)OC

InChI

InChI=1S/C26H35N3O6S/c1-27(15-14-21-8-5-4-6-9-21)36(32,33)22-12-13-24(34-2)23(20-22)28-16-18-29(19-17-28)25(30)10-7-11-26(31)35-3/h4-6,8-9,12-13,20H,7,10-11,14-19H2,1-3H3