4-[[6-(butoxycarbonylamino)benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[6-(butoxycarbonylamino)benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[6-(butoxycarbonylamino)benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[6-[[butoxy(oxo)methyl]amino]-1-benzimidazolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[6-(butoxycarbonylamino)benzimidazol-1-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[6-(butoxycarbonylamino)benzimidazol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=CC2=C(C=C1)N=CN2CC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCCCOC(=O)NC1=CC2=C(C=C1)N=CN2CC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C21H23N3O5/c1-3-4-9-29-21(27)23-16-7-8-17-18(11-16)24(13-22-17)12-15-6-5-14(20(25)26)10-19(15)28-2/h5-8,10-11,13H,3-4,9,12H2,1-2H3,(H,23,27)(H,25,26)