(8-chloranyl-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) phenyl carbonate

Systemtic Name: (8-chloranyl-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) phenyl carbonate Openeye Name: (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) phenyl carbonate CAS Name: carbonic acid (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) phenyl ester IUPAC Name: (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) phenyl carbonate Traditional Name: carbonic acid (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) phenyl ester Formula: C24H22ClNO3 MolecularWeight: 407.88938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)OC4=CC=CC=C4)Cl

Isomeric SMILES

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H22ClNO3/c1-26-13-12-18-14-22(25)23(29-24(27)28-19-10-6-3-7-11-19)15-20(18)21(16-26)17-8-4-2-5-9-17/h2-11,14-15,21H,12-13,16H2,1H3