1-(3,4-dimethylphenyl)-3-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)urea Openeye Name: 1-(3,4-dimethylphenyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea CAS Name: 1-(3,4-dimethylphenyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea Traditional Name: 1-(3,4-dimethylphenyl)-3-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-8-yl)urea Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)C)C

InChI

InChI=1S/C21H25N3O3/c1-13-6-7-15(10-14(13)2)22-20(26)23-16-8-9-17-18(11-16)27-12-21(3,4)19(25)24(17)5/h6-11H,12H2,1-5H3,(H2,22,23,26)