1-(4-tert-butylphenyl)-3-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)urea Openeye Name: 1-(4-tert-butylphenyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea CAS Name: 1-(4-tert-butylphenyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea IUPAC Name: 1-(4-tert-butylphenyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)urea Traditional Name: 1-(4-tert-butylphenyl)-3-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-8-yl)urea Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(C)(C)C)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(C)(C)C)N(C1=O)C)C

InChI

InChI=1S/C23H29N3O3/c1-22(2,3)15-7-9-16(10-8-15)24-21(28)25-17-11-12-18-19(13-17)29-14-23(4,5)20(27)26(18)6/h7-13H,14H2,1-6H3,(H2,24,25,28)