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

Systemtic Name: 1-[3,3-dimethyl-5-(2-methylpropyl)-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl]-3-[(4-methoxyphenyl)methyl]urea Openeye Name: 1-(5-isobutyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-3-[(4-methoxyphenyl)methyl]urea CAS Name: 1-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-3-[(4-methoxyphenyl)methyl]urea IUPAC Name: 1-[3,3-dimethyl-5-(2-methylpropyl)-4-oxo-2H-1,5-benzoxazepin-8-yl]-3-[(4-methoxyphenyl)methyl]urea Traditional Name: 1-(5-isobutyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-3-p-anisyl-urea Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)OC)OCC(C1=O)(C)C

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)OC)OCC(C1=O)(C)C

InChI

InChI=1S/C24H31N3O4/c1-16(2)14-27-20-11-8-18(12-21(20)31-15-24(3,4)22(27)28)26-23(29)25-13-17-6-9-19(30-5)10-7-17/h6-12,16H,13-15H2,1-5H3,(H2,25,26,29)