[4-(pyrazol-1-ylmethyl)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone

Systemtic Name: [4-(pyrazol-1-ylmethyl)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Openeye Name: [4-(pyrazol-1-ylmethyl)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone CAS Name: [4-(1-pyrazolylmethyl)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone IUPAC Name: [4-(pyrazol-1-ylmethyl)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Traditional Name: [4-(pyrazol-1-ylmethyl)phenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C1)C(=O)C3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

C1CCN(C2=CC=CC=C2C1)C(=O)C3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C21H21N3O/c25-21(24-15-4-3-7-18-6-1-2-8-20(18)24)19-11-9-17(10-12-19)16-23-14-5-13-22-23/h1-2,5-6,8-14H,3-4,7,15-16H2