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3-[[4-[3-(diethylamino)propoxycarbonyl]phenyl]methyl]-2-ethoxy-benzimidazole-5-carboxylic acid

3-[[4-[3-(diethylamino)propoxycarbonyl]phenyl]methyl]-2-ethoxy-benzimidazole-5-carboxylic acid

Systemtic Name:3-[[4-[3-(diethylamino)propoxycarbonyl]phenyl]methyl]-2-ethoxy-benzimidazole-5-carboxylic acid
Openeye Name:3-[[4-[3-(diethylamino)propoxycarbonyl]phenyl]methyl]-2-ethoxy-benzimidazole-5-carboxylic acid
CAS Name:3-[[4-[3-(diethylamino)propoxy-oxomethyl]phenyl]methyl]-2-ethoxy-5-benzimidazolecarboxylic acid
IUPAC Name:3-[[4-[3-(diethylamino)propoxycarbonyl]phenyl]methyl]-2-ethoxybenzimidazole-5-carboxylic acid
Traditional Name:3-[4-[3-(diethylamino)propoxycarbonyl]benzyl]-2-ethoxy-benzimidazole-5-carboxylic acid
Formula: C25H31N3O5
MolecularWeight: 453.53074
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC(=O)C1=CC=C(C=C1)CN2C3=C(C=CC(=C3)C(=O)O)N=C2OCC


Isomeric SMILES

CCN(CC)CCCOC(=O)C1=CC=C(C=C1)CN2C3=C(C=CC(=C3)C(=O)O)N=C2OCC


InChI

InChI=1S/C25H31N3O5/c1-4-27(5-2)14-7-15-33-24(31)19-10-8-18(9-11-19)17-28-22-16-20(23(29)30)12-13-21(22)26-25(28)32-6-3/h8-13,16H,4-7,14-15,17H2,1-3H3,(H,29,30)


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