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

Systemtic Name: 1-(3-chlorophenyl)-3-(3,3-dimethyl-4-oxidanylidene-2,5-dihydro-1,5-benzoxazepin-7-yl)urea Openeye Name: 1-(3-chlorophenyl)-3-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)urea CAS Name: 1-(3-chlorophenyl)-3-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)urea IUPAC Name: 1-(3-chlorophenyl)-3-(3,3-dimethyl-4-oxo-2,5-dihydro-1,5-benzoxazepin-7-yl)urea Traditional Name: 1-(3-chlorophenyl)-3-(4-keto-3,3-dimethyl-2,5-dihydro-1,5-benzoxazepin-7-yl)urea Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NC(=O)NC3=CC(=CC=C3)Cl)NC1=O)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)NC3=CC(=CC=C3)Cl)NC1=O)C

InChI

InChI=1S/C18H18ClN3O3/c1-18(2)10-25-15-7-6-13(9-14(15)22-16(18)23)21-17(24)20-12-5-3-4-11(19)8-12/h3-9H,10H2,1-2H3,(H,22,23)(H2,20,21,24)