N-butyl-4-(3-imidazol-1-ylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxamide

Systemtic Name: N-butyl-4-(3-imidazol-1-ylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepine-5-carboxamide Openeye Name: N-butyl-4-(3-imidazol-1-ylpropyl)-3-oxo-5H-1,4-benzoxazepine-5-carboxamide CAS Name: N-butyl-4-[3-(1-imidazolyl)propyl]-3-oxo-5H-1,4-benzoxazepine-5-carboxamide IUPAC Name: N-butyl-4-(3-imidazol-1-ylpropyl)-3-oxo-5H-1,4-benzoxazepine-5-carboxamide Traditional Name: N-butyl-4-(3-imidazol-1-ylpropyl)-3-keto-5H-1,4-benzoxazepine-5-carboxamide Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1C2=CC=CC=C2OCC(=O)N1CCCN3C=CN=C3

Isomeric SMILES

CCCCNC(=O)C1C2=CC=CC=C2OCC(=O)N1CCCN3C=CN=C3

InChI

InChI=1S/C20H26N4O3/c1-2-3-9-22-20(26)19-16-7-4-5-8-17(16)27-14-18(25)24(19)12-6-11-23-13-10-21-15-23/h4-5,7-8,10,13,15,19H,2-3,6,9,11-12,14H2,1H3,(H,22,26)