4-oxidanylidene-N-(2-pyridin-3-ylethyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanamide

Systemtic Name: 4-oxidanylidene-N-(2-pyridin-3-ylethyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanamide Openeye Name: 4-oxo-N-[2-(3-pyridyl)ethyl]-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanamide CAS Name: 4-oxo-N-[2-(3-pyridinyl)ethyl]-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanamide IUPAC Name: 4-oxo-N-(2-pyridin-3-ylethyl)-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanamide Traditional Name: 4-keto-N-[2-(3-pyridyl)ethyl]-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butyramide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC2=C1C=CC(=C2)C(=O)CCC(=O)NCCC3=CN=CC=C3

Isomeric SMILES

C1CNCCC2=C1C=CC(=C2)C(=O)CCC(=O)NCCC3=CN=CC=C3

InChI

InChI=1S/C21H25N3O2/c25-20(19-4-3-17-8-11-22-12-9-18(17)14-19)5-6-21(26)24-13-7-16-2-1-10-23-15-16/h1-4,10,14-15,22H,5-9,11-13H2,(H,24,26)