methyl N-[2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-(phenylmethyl)phenyl]sulfamate

Systemtic Name: methyl N-[2-[3-(2-hydroxyphenyl)piperazin-1-yl]-4-(phenylmethyl)phenyl]sulfamate Openeye Name: methyl N-[4-benzyl-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamate CAS Name: N-[2-[3-(2-hydroxyphenyl)-1-piperazinyl]-4-(phenylmethyl)phenyl]sulfamic acid methyl ester IUPAC Name: methyl N-[4-benzyl-2-[3-(2-hydroxyphenyl)piperazin-1-yl]phenyl]sulfamate Traditional Name: N-[4-benzyl-2-[3-(2-hydroxyphenyl)piperazino]phenyl]sulfamic acid methyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)NC1=C(C=C(C=C1)CC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

Isomeric SMILES

COS(=O)(=O)NC1=C(C=C(C=C1)CC2=CC=CC=C2)N3CCNC(C3)C4=CC=CC=C4O

InChI

InChI=1S/C24H27N3O4S/c1-31-32(29,30)26-21-12-11-19(15-18-7-3-2-4-8-18)16-23(21)27-14-13-25-22(17-27)20-9-5-6-10-24(20)28/h2-12,16,22,25-26,28H,13-15,17H2,1H3