1-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea

Systemtic Name: 1-(3,3-dimethyl-4-oxidanylidene-5-propyl-2H-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea Openeye Name: 1-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea CAS Name: 1-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea IUPAC Name: 1-(3,3-dimethyl-4-oxo-5-propyl-2H-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea Traditional Name: 1-(4-keto-3,3-dimethyl-5-propyl-2H-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)NC(=O)NCCCC3=CC=CC=C3)OCC(C1=O)(C)C

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)NC(=O)NCCCC3=CC=CC=C3)OCC(C1=O)(C)C

InChI

InChI=1S/C24H31N3O3/c1-4-15-27-20-16-19(12-13-21(20)30-17-24(2,3)22(27)28)26-23(29)25-14-8-11-18-9-6-5-7-10-18/h5-7,9-10,12-13,16H,4,8,11,14-15,17H2,1-3H3,(H2,25,26,29)