phenyl N-[2-(3-methoxypiperazin-1-yl)-2-[4-(phenylmethyl)phenyl]ethyl]sulfamate

Systemtic Name: phenyl N-[2-(3-methoxypiperazin-1-yl)-2-[4-(phenylmethyl)phenyl]ethyl]sulfamate Openeye Name: phenyl N-[2-(4-benzylphenyl)-2-(3-methoxypiperazin-1-yl)ethyl]sulfamate CAS Name: N-[2-(3-methoxy-1-piperazinyl)-2-[4-(phenylmethyl)phenyl]ethyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[2-(4-benzylphenyl)-2-(3-methoxypiperazin-1-yl)ethyl]sulfamate Traditional Name: N-[2-(4-benzylphenyl)-2-(3-methoxypiperazino)ethyl]sulfamic acid phenyl ester Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCN1)C(CNS(=O)(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

Isomeric SMILES

COC1CN(CCN1)C(CNS(=O)(=O)OC2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O4S/c1-32-26-20-29(17-16-27-26)25(19-28-34(30,31)33-24-10-6-3-7-11-24)23-14-12-22(13-15-23)18-21-8-4-2-5-9-21/h2-15,25-28H,16-20H2,1H3