methyl 2-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-2-yl)methyl]-1,3-benzoxazole-4-carboxylate

Systemtic Name: methyl 2-[(2-butyl-4-chloranyl-5-methanoyl-imidazol-2-yl)methyl]-1,3-benzoxazole-4-carboxylate Openeye Name: methyl 2-[(2-butyl-4-chloro-5-formyl-imidazol-2-yl)methyl]-1,3-benzoxazole-4-carboxylate CAS Name: 2-[(2-butyl-4-chloro-5-formyl-2-imidazolyl)methyl]-1,3-benzoxazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-butyl-4-chloro-5-formylimidazol-2-yl)methyl]-1,3-benzoxazole-4-carboxylate Traditional Name: 2-[(2-butyl-4-chloro-5-formyl-imidazol-2-yl)methyl]-1,3-benzoxazole-4-carboxylic acid methyl ester Formula: C18H18ClN3O4 MolecularWeight: 375.80622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(N=C(C(=N1)Cl)C=O)CC2=NC3=C(C=CC=C3O2)C(=O)OC

Isomeric SMILES

CCCCC1(N=C(C(=N1)Cl)C=O)CC2=NC3=C(C=CC=C3O2)C(=O)OC

InChI

InChI=1S/C18H18ClN3O4/c1-3-4-8-18(21-12(10-23)16(19)22-18)9-14-20-15-11(17(24)25-2)6-5-7-13(15)26-14/h5-7,10H,3-4,8-9H2,1-2H3