methyl 2-(4,4-dimethyl-2,3-dihydrochromen-6-yl)-3H-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-(4,4-dimethyl-2,3-dihydrochromen-6-yl)-3H-benzimidazole-5-carboxylate Openeye Name: methyl 2-(4,4-dimethylchroman-6-yl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-3H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(4,4-dimethyl-2,3-dihydrochromen-6-yl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(4,4-dimethylchroman-6-yl)-3H-benzimidazole-5-carboxylic acid methyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCOC2=C1C=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)OC)C

Isomeric SMILES

CC1(CCOC2=C1C=C(C=C2)C3=NC4=C(N3)C=C(C=C4)C(=O)OC)C

InChI

InChI=1S/C20H20N2O3/c1-20(2)8-9-25-17-7-5-12(10-14(17)20)18-21-15-6-4-13(19(23)24-3)11-16(15)22-18/h4-7,10-11H,8-9H2,1-3H3,(H,21,22)