7-chloranyl-1-[3-(dimethylamino)propyl]-5,5-diphenyl-4,1-benzoxazepin-2-one

Systemtic Name: 7-chloranyl-1-[3-(dimethylamino)propyl]-5,5-diphenyl-4,1-benzoxazepin-2-one Openeye Name: 7-chloro-1-[3-(dimethylamino)propyl]-5,5-diphenyl-4,1-benzoxazepin-2-one CAS Name: 7-chloro-1-[3-(dimethylamino)propyl]-5,5-diphenyl-4,1-benzoxazepin-2-one IUPAC Name: 7-chloro-1-[3-(dimethylamino)propyl]-5,5-diphenyl-4,1-benzoxazepin-2-one Traditional Name: 7-chloro-1-[3-(dimethylamino)propyl]-5,5-diphenyl-4,1-benzoxazepin-2-one Formula: C26H27ClN2O2 MolecularWeight: 434.95778

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(=O)COC(C2=C1C=CC(=C2)Cl)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C)CCCN1C(=O)COC(C2=C1C=CC(=C2)Cl)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27ClN2O2/c1-28(2)16-9-17-29-24-15-14-22(27)18-23(24)26(31-19-25(29)30,20-10-5-3-6-11-20)21-12-7-4-8-13-21/h3-8,10-15,18H,9,16-17,19H2,1-2H3