1-(3-chlorophenyl)-3-[4-(3-methoxypropyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[4-(3-methoxypropyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]urea Openeye Name: 1-(3-chlorophenyl)-3-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea CAS Name: 1-(3-chlorophenyl)-3-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea Traditional Name: 1-(3-chlorophenyl)-3-[3-keto-4-(3-methoxypropyl)-2-methyl-5H-1,4-benzoxazepin-7-yl]urea Formula: C21H24ClN3O4 MolecularWeight: 417.88596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)CCCOC

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)Cl)CCCOC

InChI

InChI=1S/C21H24ClN3O4/c1-14-20(26)25(9-4-10-28-2)13-15-11-18(7-8-19(15)29-14)24-21(27)23-17-6-3-5-16(22)12-17/h3,5-8,11-12,14H,4,9-10,13H2,1-2H3,(H2,23,24,27)