[6-(4-hydroxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-7,8-dihydronaphthalen-2-yl] sulfamate

Systemtic Name: [6-(4-hydroxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-7,8-dihydronaphthalen-2-yl] sulfamate Openeye Name: [6-(4-hydroxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-7,8-dihydronaphthalen-2-yl] sulfamate CAS Name: sulfamic acid [6-(4-hydroxyphenyl)-5-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-7,8-dihydronaphthalen-2-yl] ester IUPAC Name: [6-(4-hydroxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-7,8-dihydronaphthalen-2-yl] sulfamate Traditional Name: sulfamic acid [6-(4-hydroxyphenyl)-5-[4-(2-pyrrolidinoethoxy)phenyl]-7,8-dihydronaphthalen-2-yl] ester Formula: C28H30N2O5S MolecularWeight: 506.6132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(CCC4=C3C=CC(=C4)OS(=O)(=O)N)C5=CC=C(C=C5)O

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(CCC4=C3C=CC(=C4)OS(=O)(=O)N)C5=CC=C(C=C5)O

InChI

InChI=1S/C28H30N2O5S/c29-36(32,33)35-25-12-14-27-22(19-25)7-13-26(20-3-8-23(31)9-4-20)28(27)21-5-10-24(11-6-21)34-18-17-30-15-1-2-16-30/h3-6,8-12,14,19,31H,1-2,7,13,15-18H2,(H2,29,32,33)