O2-[(2-carbamimidoylphenyl)methyl] O1-naphthalen-2-yl pyrrolidine-1,2-dicarboxylate; methanesulfonate

Systemtic Name: O2-[(2-carbamimidoylphenyl)methyl] O1-naphthalen-2-yl pyrrolidine-1,2-dicarboxylate; methanesulfonate Openeye Name: O2-[(2-carbamimidoylphenyl)methyl] O1-(2-naphthyl) pyrrolidine-1,2-dicarboxylate; methanesulfonate CAS Name: methanesulfonate; pyrrolidine-1,2-dicarboxylic acid O2-[(2-carbamimidoylphenyl)methyl] ester O1-(2-naphthalenyl) ester IUPAC Name: 2-O-[(2-carbamimidoylphenyl)methyl] 1-O-naphthalen-2-yl pyrrolidine-1,2-dicarboxylate; methanesulfonate Traditional Name: pyrrolidine-1,2-dicarboxylic acid O2-(2-amidinobenzyl) ester O1-(2-naphthyl) ester mesylate Formula: C25H26N3O7S- MolecularWeight: 512.55484

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1CC(N(C1)C(=O)OC2=CC3=CC=CC=C3C=C2)C(=O)OCC4=CC=CC=C4C(=N)N

Isomeric SMILES

CS(=O)(=O)[O-].C1CC(N(C1)C(=O)OC2=CC3=CC=CC=C3C=C2)C(=O)OCC4=CC=CC=C4C(=N)N

InChI

InChI=1S/C24H23N3O4.CH4O3S/c25-22(26)20-9-4-3-8-18(20)15-30-23(28)21-10-5-13-27(21)24(29)31-19-12-11-16-6-1-2-7-17(16)14-19;1-5(2,3)4/h1-4,6-9,11-12,14,21H,5,10,13,15H2,(H3,25,26);1H3,(H,2,3,4)/p-1