(6-carbamimidoylnaphthalen-2-yl) 1-methylsulfonyloxycyclobutane-1-carboxylate

Systemtic Name: (6-carbamimidoylnaphthalen-2-yl) 1-methylsulfonyloxycyclobutane-1-carboxylate Openeye Name: (6-carbamimidoyl-2-naphthyl) 1-methylsulfonyloxycyclobutanecarboxylate CAS Name: 1-methylsulfonyloxy-1-cyclobutanecarboxylic acid (6-carbamimidoyl-2-naphthalenyl) ester IUPAC Name: (6-carbamimidoylnaphthalen-2-yl) 1-methylsulfonyloxycyclobutane-1-carboxylate Traditional Name: 1-methylsulfonyloxycyclobutanecarboxylic acid (6-amidino-2-naphthyl) ester Formula: C17H18N2O5S MolecularWeight: 362.40022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1(CCC1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N

Isomeric SMILES

CS(=O)(=O)OC1(CCC1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N

InChI

InChI=1S/C17H18N2O5S/c1-25(21,22)24-17(7-2-8-17)16(20)23-14-6-5-11-9-13(15(18)19)4-3-12(11)10-14/h3-6,9-10H,2,7-8H2,1H3,(H3,18,19)