5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]pyrimidine-2-carboxylic acid

Systemtic Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]pyrimidine-2-carboxylic acid Openeye Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]pyrimidine-2-carboxylic acid CAS Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]-2-pyrimidinecarboxylic acid IUPAC Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]pyrimidine-2-carboxylic acid Traditional Name: 5-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]pyrimidine-2-carboxylic acid Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)OC4=CN=C(N=C4)C(=O)O

Isomeric SMILES

C1CC(C1)N2CCC3=C(CC2)C=C(C=C3)OC4=CN=C(N=C4)C(=O)O

InChI

InChI=1S/C19H21N3O3/c23-19(24)18-20-11-17(12-21-18)25-16-5-4-13-6-8-22(15-2-1-3-15)9-7-14(13)10-16/h4-5,10-12,15H,1-3,6-9H2,(H,23,24)