1-(4-fluorophenyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl)butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl)butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl)butan-1-one CAS Name: 1-(4-fluorophenyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl)-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl)butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl)butan-1-one Formula: C20H23FNO+ MolecularWeight: 312.401123

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC2=CC=CC=C21)CCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1C[NH+](CCC2=CC=CC=C21)CCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FNO/c21-19-9-7-18(8-10-19)20(23)6-3-13-22-14-11-16-4-1-2-5-17(16)12-15-22/h1-2,4-5,7-10H,3,6,11-15H2/p+1