[8-acetyloxy-5-phenyl-3-(phenylmethyl)-9-propyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ethanoate

Systemtic Name: [8-acetyloxy-5-phenyl-3-(phenylmethyl)-9-propyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ethanoate Openeye Name: (8-acetoxy-3-benzyl-5-phenyl-9-propyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) acetate CAS Name: acetic acid [8-acetyloxy-5-phenyl-3-(phenylmethyl)-9-propyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl] ester IUPAC Name: (8-acetyloxy-3-benzyl-5-phenyl-9-propyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) acetate Traditional Name: acetic acid (8-acetoxy-3-benzyl-5-phenyl-9-propyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) ester Formula: C30H33NO4 MolecularWeight: 471.58732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCN(CC(C2=CC(=C1OC(=O)C)OC(=O)C)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCCC1=C2CCN(CC(C2=CC(=C1OC(=O)C)OC(=O)C)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C30H33NO4/c1-4-11-26-25-16-17-31(19-23-12-7-5-8-13-23)20-28(24-14-9-6-10-15-24)27(25)18-29(34-21(2)32)30(26)35-22(3)33/h5-10,12-15,18,28H,4,11,16-17,19-20H2,1-3H3