1-(4-butan-2-yl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-(3-methoxyphenyl)urea

Systemtic Name: 1-(4-butan-2-yl-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl)-3-(3-methoxyphenyl)urea Openeye Name: 1-(2-ethyl-3-oxo-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-3-(3-methoxyphenyl)urea CAS Name: 1-(4-butan-2-yl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-methoxyphenyl)urea IUPAC Name: 1-(4-butan-2-yl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(3-methoxyphenyl)urea Traditional Name: 1-(2-ethyl-3-keto-4-sec-butyl-5H-1,4-benzoxazepin-7-yl)-3-(3-methoxyphenyl)urea Formula: C23H29N3O4 MolecularWeight: 411.49406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)OC)C(C)CC

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)OC)C(C)CC

InChI

InChI=1S/C23H29N3O4/c1-5-15(3)26-14-16-12-18(10-11-21(16)30-20(6-2)22(26)27)25-23(28)24-17-8-7-9-19(13-17)29-4/h7-13,15,20H,5-6,14H2,1-4H3,(H2,24,25,28)