1-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-8-yl)-3-prop-2-enyl-urea

Systemtic Name: 1-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-8-yl)-3-prop-2-enyl-urea Openeye Name: 1-allyl-3-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-8-yl)urea CAS Name: 1-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-8-yl)-3-prop-2-enylurea IUPAC Name: 1-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-8-yl)-3-prop-2-enylurea Traditional Name: 1-allyl-3-(4-keto-3,3-dimethyl-5-propyl-2H-1,5-benzoxazepin-8-yl)urea Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)NCC=C)OCC(C1=O)(C)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)NCC=C)OCC(C1=O)(C)C

InChI

InChI=1S/C18H25N3O3/c1-5-9-19-17(23)20-13-7-8-14-15(11-13)24-12-18(3,4)16(22)21(14)10-6-2/h5,7-8,11H,1,6,9-10,12H2,2-4H3,(H2,19,20,23)