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

Systemtic Name: methyl N-[4-(2-hydroxyphenyl)-2-(3-methoxypiperazin-1-yl)phenyl]sulfamate Openeye Name: methyl N-[4-(2-hydroxyphenyl)-2-(3-methoxypiperazin-1-yl)phenyl]sulfamate CAS Name: N-[4-(2-hydroxyphenyl)-2-(3-methoxy-1-piperazinyl)phenyl]sulfamic acid methyl ester IUPAC Name: methyl N-[4-(2-hydroxyphenyl)-2-(3-methoxypiperazin-1-yl)phenyl]sulfamate Traditional Name: N-[4-(2-hydroxyphenyl)-2-(3-methoxypiperazino)phenyl]sulfamic acid methyl ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)OC

Isomeric SMILES

COC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)OC

InChI

InChI=1S/C18H23N3O5S/c1-25-18-12-21(10-9-19-18)16-11-13(14-5-3-4-6-17(14)22)7-8-15(16)20-27(23,24)26-2/h3-8,11,18-20,22H,9-10,12H2,1-2H3