2-[1-(6-carbamimidoylnaphthalen-2-yl)cyclopent-2-en-1-yl]ethanoate; methanesulfonate

Systemtic Name: 2-[1-(6-carbamimidoylnaphthalen-2-yl)cyclopent-2-en-1-yl]ethanoate; methanesulfonate Openeye Name: 2-[1-(6-carbamimidoyl-2-naphthyl)cyclopent-2-en-1-yl]acetate; methanesulfonate CAS Name: 2-[1-(6-carbamimidoyl-2-naphthalenyl)-1-cyclopent-2-enyl]acetate; methanesulfonate IUPAC Name: 2-[1-(6-carbamimidoylnaphthalen-2-yl)cyclopent-2-en-1-yl]acetate; methanesulfonate Traditional Name: 2-[1-(6-amidino-2-naphthyl)cyclopent-2-en-1-yl]acetate mesylate Formula: C19H20N2O5S-2 MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1CC(C=C1)(CC(=O)[O-])C2=CC3=C(C=C2)C=C(C=C3)C(=N)N

Isomeric SMILES

CS(=O)(=O)[O-].C1CC(C=C1)(CC(=O)[O-])C2=CC3=C(C=C2)C=C(C=C3)C(=N)N

InChI

InChI=1S/C18H18N2O2.CH4O3S/c19-17(20)14-4-3-13-10-15(6-5-12(13)9-14)18(11-16(21)22)7-1-2-8-18;1-5(2,3)4/h1,3-7,9-10H,2,8,11H2,(H3,19,20)(H,21,22);1H3,(H,2,3,4)/p-2