2-(3,5-diethoxyphenyl)-3H-benzimidazole-5-sulfonic acid

Systemtic Name: 2-(3,5-diethoxyphenyl)-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-(3,5-diethoxyphenyl)-3H-benzimidazole-5-sulfonic acid CAS Name: 2-(3,5-diethoxyphenyl)-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-(3,5-diethoxyphenyl)-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-(3,5-diethoxyphenyl)-3H-benzimidazole-5-sulfonic acid Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O)OCC

InChI

InChI=1S/C17H18N2O5S/c1-3-23-12-7-11(8-13(9-12)24-4-2)17-18-15-6-5-14(25(20,21)22)10-16(15)19-17/h5-10H,3-4H2,1-2H3,(H,18,19)(H,20,21,22)