6-chloranyl-1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 6-chloranyl-1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 6-chloro-1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxo-quinoline-3-carboxamide CAS Name: 6-chloro-1-[[4-(1-imidazolylmethyl)phenyl]methyl]-4-oxo-3-quinolinecarboxamide IUPAC Name: 6-chloro-1-[[4-(imidazol-1-ylmethyl)phenyl]methyl]-4-oxoquinoline-3-carboxamide Traditional Name: 6-chloro-1-[4-(imidazol-1-ylmethyl)benzyl]-4-keto-quinoline-3-carboxamide Formula: C21H17ClN4O2 MolecularWeight: 392.83828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CN=C2)CN3C=C(C(=O)C4=C3C=CC(=C4)Cl)C(=O)N

Isomeric SMILES

C1=CC(=CC=C1CN2C=CN=C2)CN3C=C(C(=O)C4=C3C=CC(=C4)Cl)C(=O)N

InChI

InChI=1S/C21H17ClN4O2/c22-16-5-6-19-17(9-16)20(27)18(21(23)28)12-26(19)11-15-3-1-14(2-4-15)10-25-8-7-24-13-25/h1-9,12-13H,10-11H2,(H2,23,28)