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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(N=C(C(=N1)Cl)C=O)CC2=NC3=C(O2)C=CC(=C3)C(=O)OC

Isomeric SMILES

CCCCC1(N=C(C(=N1)Cl)C=O)CC2=NC3=C(O2)C=CC(=C3)C(=O)OC

InChI

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