4-[[7-methoxy-2-(methoxymethyl)-1H-benzimidazol-4-yl]carbonylamino]-3,5-dimethyl-benzoic acid

Systemtic Name: 4-[[7-methoxy-2-(methoxymethyl)-1H-benzimidazol-4-yl]carbonylamino]-3,5-dimethyl-benzoic acid Openeye Name: 4-[[7-methoxy-2-(methoxymethyl)-1H-benzimidazole-4-carbonyl]amino]-3,5-dimethyl-benzoic acid CAS Name: 4-[[[7-methoxy-2-(methoxymethyl)-1H-benzimidazol-4-yl]-oxomethyl]amino]-3,5-dimethylbenzoic acid IUPAC Name: 4-[[7-methoxy-2-(methoxymethyl)-1H-benzimidazole-4-carbonyl]amino]-3,5-dimethylbenzoic acid Traditional Name: 4-[[7-methoxy-2-(methoxymethyl)-1H-benzimidazole-4-carbonyl]amino]-3,5-dimethyl-benzoic acid Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C2=C3C(=C(C=C2)OC)NC(=N3)COC)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C2=C3C(=C(C=C2)OC)NC(=N3)COC)C)C(=O)O

InChI

InChI=1S/C20H21N3O5/c1-10-7-12(20(25)26)8-11(2)16(10)23-19(24)13-5-6-14(28-4)18-17(13)21-15(22-18)9-27-3/h5-8H,9H2,1-4H3,(H,21,22)(H,23,24)(H,25,26)