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

Systemtic Name: 1-(3-phenylpropyl)-3-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)urea Openeye Name: 1-(3-phenylpropyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea CAS Name: 1-(3-phenylpropyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea IUPAC Name: 1-(3-phenylpropyl)-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea Traditional Name: 1-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-7-yl)-3-(3-phenylpropyl)urea Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NC(=O)NCCCC3=CC=CC=C3)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)NCCCC3=CC=CC=C3)N(C1=O)C)C

InChI

InChI=1S/C22H27N3O3/c1-22(2)15-28-19-12-11-17(14-18(19)25(3)20(22)26)24-21(27)23-13-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-12,14H,7,10,13,15H2,1-3H3,(H2,23,24,27)