ethyl 1-[3-[(1-methylimidazol-2-yl)methoxymethyl]phenyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-[3-[(1-methylimidazol-2-yl)methoxymethyl]phenyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-[3-[(1-methylimidazol-2-yl)methoxymethyl]phenyl]benzimidazole-5-carboxylate CAS Name: 1-[3-[(1-methyl-2-imidazolyl)methoxymethyl]phenyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(1-methylimidazol-2-yl)methoxymethyl]phenyl]benzimidazole-5-carboxylate Traditional Name: 1-[3-[(1-methylimidazol-2-yl)methoxymethyl]phenyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC=CC(=C3)COCC4=NC=CN4C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC=CC(=C3)COCC4=NC=CN4C

InChI

InChI=1S/C22H22N4O3/c1-3-29-22(27)17-7-8-20-19(12-17)24-15-26(20)18-6-4-5-16(11-18)13-28-14-21-23-9-10-25(21)2/h4-12,15H,3,13-14H2,1-2H3