5-chloranyl-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: 5-chloro-N-[[4-(1-imidazolylmethyl)phenyl]methyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: 5-chloro-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-N-[4-(imidazol-1-ylmethyl)benzyl]coumaran-2-carboxamide Formula: C20H18ClN3O2 MolecularWeight: 367.82882

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)CN4C=CN=C4

InChI

InChI=1S/C20H18ClN3O2/c21-17-5-6-18-16(9-17)10-19(26-18)20(25)23-11-14-1-3-15(4-2-14)12-24-8-7-22-13-24/h1-9,13,19H,10-12H2,(H,23,25)