N-[3-(imidazol-1-ylmethyl)phenyl]-2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanamide

Systemtic Name: N-[3-(imidazol-1-ylmethyl)phenyl]-2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanamide Openeye Name: N-[3-(imidazol-1-ylmethyl)phenyl]-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide CAS Name: N-[3-(1-imidazolylmethyl)phenyl]-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide IUPAC Name: N-[3-(imidazol-1-ylmethyl)phenyl]-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide Traditional Name: N-[3-(imidazol-1-ylmethyl)phenyl]-2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC=CC(=C3)CN4C=CN=C4

InChI

InChI=1S/C21H20N4O3/c26-20(14-25-18-6-1-2-7-19(18)28-11-8-21(25)27)23-17-5-3-4-16(12-17)13-24-10-9-22-15-24/h1-7,9-10,12,15H,8,11,13-14H2,(H,23,26)