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

Systemtic Name: (8-chloranyl-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) morpholine-4-carboxylate Openeye Name: (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) ester IUPAC Name: (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) ester Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)N4CCOCC4)Cl

Isomeric SMILES

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)N4CCOCC4)Cl

InChI

InChI=1S/C22H25ClN2O3/c1-24-8-7-17-13-20(23)21(28-22(26)25-9-11-27-12-10-25)14-18(17)19(15-24)16-5-3-2-4-6-16/h2-6,13-14,19H,7-12,15H2,1H3