phenyl 5-ethoxy-2-(3-methoxypiperazin-1-yl)benzenesulfonate

Systemtic Name: phenyl 5-ethoxy-2-(3-methoxypiperazin-1-yl)benzenesulfonate Openeye Name: phenyl 5-ethoxy-2-(3-methoxypiperazin-1-yl)benzenesulfonate CAS Name: 5-ethoxy-2-(3-methoxy-1-piperazinyl)benzenesulfonic acid phenyl ester IUPAC Name: phenyl 5-ethoxy-2-(3-methoxypiperazin-1-yl)benzenesulfonate Traditional Name: 5-ethoxy-2-(3-methoxypiperazino)benzenesulfonic acid phenyl ester Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)N2CCNC(C2)OC)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC(=C(C=C1)N2CCNC(C2)OC)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C19H24N2O5S/c1-3-25-16-9-10-17(21-12-11-20-19(14-21)24-2)18(13-16)27(22,23)26-15-7-5-4-6-8-15/h4-10,13,19-20H,3,11-12,14H2,1-2H3