[4-carbamimidoyl-2-(phenylcarbonyl)phenyl] 4-(dimethylamino)benzoate; methanesulfonic acid

Systemtic Name: [4-carbamimidoyl-2-(phenylcarbonyl)phenyl] 4-(dimethylamino)benzoate; methanesulfonic acid Openeye Name: (2-benzoyl-4-carbamimidoyl-phenyl) 4-(dimethylamino)benzoate; methanesulfonic acid CAS Name: 4-(dimethylamino)benzoic acid (2-benzoyl-4-carbamimidoylphenyl) ester; methanesulfonic acid IUPAC Name: (2-benzoyl-4-carbamimidoylphenyl) 4-(dimethylamino)benzoate; methanesulfonic acid Traditional Name: 4-(dimethylamino)benzoic acid (4-amidino-2-benzoyl-phenyl) ester; mesylic acid Formula: C24H25N3O6S MolecularWeight: 483.5368

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=N)N)C(=O)C3=CC=CC=C3.CS(=O)(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(=N)N)C(=O)C3=CC=CC=C3.CS(=O)(=O)O

InChI

InChI=1S/C23H21N3O3.CH4O3S/c1-26(2)18-11-8-16(9-12-18)23(28)29-20-13-10-17(22(24)25)14-19(20)21(27)15-6-4-3-5-7-15;1-5(2,3)4/h3-14H,1-2H3,(H3,24,25);1H3,(H,2,3,4)