methanesulfonic acid; N'-(4-phenylmethoxyphenyl)-2,3-dihydroindole-1-carboximidamide

Systemtic Name: methanesulfonic acid; N'-(4-phenylmethoxyphenyl)-2,3-dihydroindole-1-carboximidamide Openeye Name: N'-(4-benzyloxyphenyl)indoline-1-carboxamidine; methanesulfonic acid CAS Name: methanesulfonic acid; N'-(4-phenylmethoxyphenyl)-2,3-dihydroindole-1-carboximidamide IUPAC Name: methanesulfonic acid; N'-(4-phenylmethoxyphenyl)-2,3-dihydroindole-1-carboximidamide Traditional Name: N'-(4-benzoxyphenyl)indoline-1-carboxamidine; mesylic acid Formula: C23H25N3O4S MolecularWeight: 439.5273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1CN(C2=CC=CC=C21)C(=NC3=CC=C(C=C3)OCC4=CC=CC=C4)N

Isomeric SMILES

CS(=O)(=O)O.C1CN(C2=CC=CC=C21)C(=NC3=CC=C(C=C3)OCC4=CC=CC=C4)N

InChI

InChI=1S/C22H21N3O.CH4O3S/c23-22(25-15-14-18-8-4-5-9-21(18)25)24-19-10-12-20(13-11-19)26-16-17-6-2-1-3-7-17;1-5(2,3)4/h1-13H,14-16H2,(H2,23,24);1H3,(H,2,3,4)