phenyl N-[2-[3-(2-hydroxyphenyl)piperazin-1-yl]-2-(4-methylphenyl)ethyl]sulfamate

Systemtic Name: phenyl N-[2-[3-(2-hydroxyphenyl)piperazin-1-yl]-2-(4-methylphenyl)ethyl]sulfamate Openeye Name: phenyl N-[2-[3-(2-hydroxyphenyl)piperazin-1-yl]-2-(p-tolyl)ethyl]sulfamate CAS Name: N-[2-[3-(2-hydroxyphenyl)-1-piperazinyl]-2-(4-methylphenyl)ethyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[2-[3-(2-hydroxyphenyl)piperazin-1-yl]-2-(4-methylphenyl)ethyl]sulfamate Traditional Name: N-[2-[3-(2-hydroxyphenyl)piperazino]-2-(p-tolyl)ethyl]sulfamic acid phenyl ester Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNS(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

Isomeric SMILES

CC1=CC=C(C=C1)C(CNS(=O)(=O)OC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

InChI

InChI=1S/C25H29N3O4S/c1-19-11-13-20(14-12-19)24(17-27-33(30,31)32-21-7-3-2-4-8-21)28-16-15-26-23(18-28)22-9-5-6-10-25(22)29/h2-14,23-24,26-27,29H,15-18H2,1H3