[5-bromanyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]naphthalen-2-yl]methanesulfonate

Systemtic Name: [5-bromanyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]naphthalen-2-yl]methanesulfonate Openeye Name: [5-bromo-8-(tert-butoxycarbonylamino)-2-naphthyl]methanesulfonate CAS Name: [5-bromo-8-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-naphthalenyl]methanesulfonate IUPAC Name: [5-bromo-8-[(2-methylpropan-2-yl)oxycarbonylamino]naphthalen-2-yl]methanesulfonate Traditional Name: [5-bromo-8-(tert-butoxycarbonylamino)-2-naphthyl]methanesulfonate Formula: C16H17BrNO5S- MolecularWeight: 415.27888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C2C=C(C=CC2=C(C=C1)Br)CS(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C2C=C(C=CC2=C(C=C1)Br)CS(=O)(=O)[O-]

InChI

InChI=1S/C16H18BrNO5S/c1-16(2,3)23-15(19)18-14-7-6-13(17)11-5-4-10(8-12(11)14)9-24(20,21)22/h4-8H,9H2,1-3H3,(H,18,19)(H,20,21,22)/p-1