1-[(3,4-dimethoxyphenyl)methyl]-3-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-7-yl)urea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-7-yl)urea Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-7-yl)urea CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-7-yl)urea IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-7-yl)urea Traditional Name: 1-(4-keto-3,3-dimethyl-5-propyl-2H-1,5-benzoxazepin-7-yl)-3-veratryl-urea Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)NC(=O)NCC3=CC(=C(C=C3)OC)OC)OCC(C1=O)(C)C

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)NC(=O)NCC3=CC(=C(C=C3)OC)OC)OCC(C1=O)(C)C

InChI

InChI=1S/C24H31N3O5/c1-6-11-27-18-13-17(8-10-19(18)32-15-24(2,3)22(27)28)26-23(29)25-14-16-7-9-20(30-4)21(12-16)31-5/h7-10,12-13H,6,11,14-15H2,1-5H3,(H2,25,26,29)