3,4-bis(chloranyl)-N-[4-(3-methoxypropyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: 3,4-bis(chloranyl)-N-[4-(3-methoxypropyl)-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: 3,4-dichloro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide CAS Name: 3,4-dichloro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: 3,4-dichloro-N-[4-(3-methoxypropyl)-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: 3,4-dichloro-N-[3-keto-4-(3-methoxypropyl)-2-methyl-5H-1,4-benzoxazepin-7-yl]benzamide Formula: C21H22Cl2N2O4 MolecularWeight: 437.31638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22Cl2N2O4/c1-13-21(27)25(8-3-9-28-2)12-15-10-16(5-7-19(15)29-13)24-20(26)14-4-6-17(22)18(23)11-14/h4-7,10-11,13H,3,8-9,12H2,1-2H3,(H,24,26)