butyl 4-[[4-(imidazol-1-ylmethyl)phenyl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[4-(imidazol-1-ylmethyl)phenyl]carbonylamino]benzoate Openeye Name: butyl 4-[[4-(imidazol-1-ylmethyl)benzoyl]amino]benzoate CAS Name: 4-[[[4-(1-imidazolylmethyl)phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[4-(imidazol-1-ylmethyl)benzoyl]amino]benzoate Traditional Name: 4-[[4-(imidazol-1-ylmethyl)benzoyl]amino]benzoic acid butyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=CN=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C=CN=C3

InChI

InChI=1S/C22H23N3O3/c1-2-3-14-28-22(27)19-8-10-20(11-9-19)24-21(26)18-6-4-17(5-7-18)15-25-13-12-23-16-25/h4-13,16H,2-3,14-15H2,1H3,(H,24,26)