1-(6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(phenylmethyl)urea

Systemtic Name: 1-(6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)urea CAS Name: 1-(6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)urea Traditional Name: 1-benzyl-3-(6-keto-5H-benzo[b][1,4]benzoxazepin-8-yl)urea Formula: C21H17N3O3 MolecularWeight: 359.37798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H17N3O3/c25-20-16-12-15(23-21(26)22-13-14-6-2-1-3-7-14)10-11-18(16)27-19-9-5-4-8-17(19)24-20/h1-12H,13H2,(H,24,25)(H2,22,23,26)