1-[2-(4-methoxyphenyl)ethyl]-3-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)urea

Systemtic Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-7-yl)urea Openeye Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea CAS Name: 1-[2-(4-methoxyphenyl)ethyl]-3-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-7-yl)urea IUPAC Name: 1-[2-(4-methoxyphenyl)ethyl]-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-[2-(4-methoxyphenyl)ethyl]urea Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NC(=O)NCCC3=CC=C(C=C3)OC)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NC(=O)NCCC3=CC=C(C=C3)OC)N(C1=O)C)C

InChI

InChI=1S/C22H27N3O4/c1-22(2)14-29-19-10-7-16(13-18(19)25(3)20(22)26)24-21(27)23-12-11-15-5-8-17(28-4)9-6-15/h5-10,13H,11-12,14H2,1-4H3,(H2,23,24,27)