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

Systemtic Name: 1-(3,3-dimethyl-4-oxidanylidene-2,5-dihydro-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea Openeye Name: 1-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea CAS Name: 1-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea IUPAC Name: 1-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea Traditional Name: 1-(4-keto-3,3-dimethyl-2,5-dihydro-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NC(=O)NCCCC3=CC=CC=C3)NC1=O)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)NCCCC3=CC=CC=C3)NC1=O)C

InChI

InChI=1S/C21H25N3O3/c1-21(2)14-27-18-11-10-16(13-17(18)24-19(21)25)23-20(26)22-12-6-9-15-7-4-3-5-8-15/h3-5,7-8,10-11,13H,6,9,12,14H2,1-2H3,(H,24,25)(H2,22,23,26)