3-(3-chlorophenyl)-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)prop-2-yn-1-one

Systemtic Name: 3-(3-chlorophenyl)-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)prop-2-yn-1-one Openeye Name: 3-(3-chlorophenyl)-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)prop-2-yn-1-one CAS Name: 3-(3-chlorophenyl)-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-2-propyn-1-one IUPAC Name: 3-(3-chlorophenyl)-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)prop-2-yn-1-one Traditional Name: 3-(3-chlorophenyl)-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)prop-2-yn-1-one Formula: C19H16ClNO MolecularWeight: 309.78944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=CC=CC=C21)C(=O)C#CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCC2=CC=CC=C21)C(=O)C#CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H16ClNO/c20-18-7-3-4-15(14-18)8-9-19(22)21-12-10-16-5-1-2-6-17(16)11-13-21/h1-7,14H,10-13H2