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

Systemtic Name: (8-chloranyl-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) 3-oxidanylazetidine-1-carboxylate Openeye Name: (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) 3-hydroxyazetidine-1-carboxylate CAS Name: 3-hydroxy-1-azetidinecarboxylic 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) 3-hydroxyazetidine-1-carboxylate Traditional Name: 3-hydroxyazetidine-1-carboxylic acid (8-chloro-3-methyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl) ester Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)N4CC(C4)O)Cl

Isomeric SMILES

CN1CCC2=CC(=C(C=C2C(C1)C3=CC=CC=C3)OC(=O)N4CC(C4)O)Cl

InChI

InChI=1S/C21H23ClN2O3/c1-23-8-7-15-9-19(22)20(27-21(26)24-11-16(25)12-24)10-17(15)18(13-23)14-5-3-2-4-6-14/h2-6,9-10,16,18,25H,7-8,11-13H2,1H3