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

Systemtic Name: phenyl N-[2-(3-ethoxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]sulfamate Openeye Name: phenyl N-[2-(3-ethoxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]sulfamate CAS Name: N-[2-(3-ethoxy-1-piperazinyl)-2-(4-phenylphenyl)ethyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[2-(3-ethoxypiperazin-1-yl)-2-(4-phenylphenyl)ethyl]sulfamate Traditional Name: N-[2-(3-ethoxypiperazino)-2-(4-phenylphenyl)ethyl]sulfamic acid phenyl ester Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CCN1)C(CNS(=O)(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1CN(CCN1)C(CNS(=O)(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O4S/c1-2-32-26-20-29(18-17-27-26)25(19-28-34(30,31)33-24-11-7-4-8-12-24)23-15-13-22(14-16-23)21-9-5-3-6-10-21/h3-16,25-28H,2,17-20H2,1H3