1-(3-chlorophenyl)-3-[3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]urea Openeye Name: 1-(4-benzyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea CAS Name: 1-(3-chlorophenyl)-3-[3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]urea IUPAC Name: 1-(4-benzyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea Traditional Name: 1-(4-benzyl-3-keto-5H-1,4-benzoxazepin-7-yl)-3-(3-chlorophenyl)urea Formula: C23H20ClN3O3 MolecularWeight: 421.8762

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)OCC(=O)N1CC4=CC=CC=C4

Isomeric SMILES

C1C2=C(C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)OCC(=O)N1CC4=CC=CC=C4

InChI

InChI=1S/C23H20ClN3O3/c24-18-7-4-8-19(12-18)25-23(29)26-20-9-10-21-17(11-20)14-27(22(28)15-30-21)13-16-5-2-1-3-6-16/h1-12H,13-15H2,(H2,25,26,29)