1-(5-chloranyl-2-methoxy-phenyl)-3-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]urea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-[3,3-dimethyl-5-(3-methylbutyl)-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl]urea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-(5-isopentyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]urea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-[3,3-dimethyl-5-(3-methylbutyl)-4-oxo-2H-1,5-benzoxazepin-7-yl]urea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-(5-isoamyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-7-yl)urea Formula: C24H30ClN3O4 MolecularWeight: 459.9657

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(C=CC(=C2)NC(=O)NC3=C(C=CC(=C3)Cl)OC)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CCN1C2=C(C=CC(=C2)NC(=O)NC3=C(C=CC(=C3)Cl)OC)OCC(C1=O)(C)C

InChI

InChI=1S/C24H30ClN3O4/c1-15(2)10-11-28-19-13-17(7-9-21(19)32-14-24(3,4)22(28)29)26-23(30)27-18-12-16(25)6-8-20(18)31-5/h6-9,12-13,15H,10-11,14H2,1-5H3,(H2,26,27,30)