1-(3,4-dimethoxyphenyl)-3-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]urea

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]urea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-(5-isobutyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]urea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]urea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-(5-isobutyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)urea Formula: C24H31N3O5 MolecularWeight: 441.52004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)OC)OC)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)OC)OC)OCC(C1=O)(C)C

InChI

InChI=1S/C24H31N3O5/c1-15(2)13-27-18-9-7-16(11-20(18)32-14-24(3,4)22(27)28)25-23(29)26-17-8-10-19(30-5)21(12-17)31-6/h7-12,15H,13-14H2,1-6H3,(H2,25,26,29)