phenyl N-[2-(3-oxidanylpiperazin-1-yl)-2-(4-phenylphenyl)ethyl]sulfamate

Systemtic Name: phenyl N-[2-(3-oxidanylpiperazin-1-yl)-2-(4-phenylphenyl)ethyl]sulfamate Openeye Name: phenyl N-[2-(3-hydroxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]sulfamate CAS Name: N-[2-(3-hydroxy-1-piperazinyl)-2-(4-phenylphenyl)ethyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[2-(3-hydroxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]sulfamate Traditional Name: N-[2-(3-hydroxypiperazino)-2-(4-phenylphenyl)ethyl]sulfamic acid phenyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)O)C(CNS(=O)(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC(N1)O)C(CNS(=O)(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O4S/c28-24-18-27(16-15-25-24)23(17-26-32(29,30)31-22-9-5-2-6-10-22)21-13-11-20(12-14-21)19-7-3-1-4-8-19/h1-14,23-26,28H,15-18H2