N-[bis(azanyl)methylidene]-3-(2-hydroxyethyloxy)-5-phenyl-benzamide; methanesulfonate

Systemtic Name: N-[bis(azanyl)methylidene]-3-(2-hydroxyethyloxy)-5-phenyl-benzamide; methanesulfonate Openeye Name: N-(diaminomethylene)-3-(2-hydroxyethoxy)-5-phenyl-benzamide; methanesulfonate CAS Name: N-(diaminomethylidene)-3-(2-hydroxyethoxy)-5-phenylbenzamide; methanesulfonate IUPAC Name: N-(diaminomethylidene)-3-(2-hydroxyethoxy)-5-phenylbenzamide; methanesulfonate Traditional Name: N-(diaminomethylene)-3-(2-hydroxyethoxy)-5-phenyl-benzamide mesylate Formula: C17H20N3O6S- MolecularWeight: 394.4222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1=CC=C(C=C1)C2=CC(=CC(=C2)OCCO)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)[O-].C1=CC=C(C=C1)C2=CC(=CC(=C2)OCCO)C(=O)N=C(N)N

InChI

InChI=1S/C16H17N3O3.CH4O3S/c17-16(18)19-15(21)13-8-12(11-4-2-1-3-5-11)9-14(10-13)22-7-6-20;1-5(2,3)4/h1-5,8-10,20H,6-7H2,(H4,17,18,19,21);1H3,(H,2,3,4)/p-1