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

Systemtic Name: 1-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3-[(4-methoxyphenyl)methyl]urea Openeye Name: 1-(5-allyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-3-[(4-methoxyphenyl)methyl]urea CAS Name: 1-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3-[(4-methoxyphenyl)methyl]urea IUPAC Name: 1-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3-[(4-methoxyphenyl)methyl]urea Traditional Name: 1-(5-allyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-3-p-anisyl-urea Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=CC(=C2)NC(=O)NCC3=CC=C(C=C3)OC)N(C1=O)CC=C)C

Isomeric SMILES

CC1(COC2=C(C=CC(=C2)NC(=O)NCC3=CC=C(C=C3)OC)N(C1=O)CC=C)C

InChI

InChI=1S/C23H27N3O4/c1-5-12-26-19-11-8-17(13-20(19)30-15-23(2,3)21(26)27)25-22(28)24-14-16-6-9-18(29-4)10-7-16/h5-11,13H,1,12,14-15H2,2-4H3,(H2,24,25,28)