2-[(6-chloranyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-9-yl)oxy]ethanoic acid

Systemtic Name: 2-[(6-chloranyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-9-yl)oxy]ethanoic acid Openeye Name: 2-[(6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-9-yl)oxy]acetic acid CAS Name: 2-[(6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-9-yl)oxy]acetic acid IUPAC Name: 2-[(6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-9-yl)oxy]acetic acid Traditional Name: 2-[(6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-9-yl)oxy]acetic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C=CC(=C2CC1)Cl)OCC(=O)O

Isomeric SMILES

CN1CCC2=C(C=CC(=C2CC1)Cl)OCC(=O)O

InChI

InChI=1S/C13H16ClNO3/c1-15-6-4-9-10(5-7-15)12(3-2-11(9)14)18-8-13(16)17/h2-3H,4-8H2,1H3,(H,16,17)