3-[4-(2-methylphenyl)piperidin-1-yl]-4-oxidanylidene-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal

Systemtic Name: 3-[4-(2-methylphenyl)piperidin-1-yl]-4-oxidanylidene-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal Openeye Name: 3-[4-(o-tolyl)-1-piperidyl]-4-oxo-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal CAS Name: 3-[4-(2-methylphenyl)-1-piperidinyl]-4-oxo-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal IUPAC Name: 3-[4-(2-methylphenyl)piperidin-1-yl]-4-oxo-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal Traditional Name: 4-keto-3-[4-(o-tolyl)piperidino]-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butyraldehyde Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CCN(CC2)C(CC=O)C(=O)C3=CC4=C(CCNCC4)C=C3

Isomeric SMILES

CC1=CC=CC=C1C2CCN(CC2)C(CC=O)C(=O)C3=CC4=C(CCNCC4)C=C3

InChI

InChI=1S/C26H32N2O2/c1-19-4-2-3-5-24(19)21-10-15-28(16-11-21)25(12-17-29)26(30)23-7-6-20-8-13-27-14-9-22(20)18-23/h2-7,17-18,21,25,27H,8-16H2,1H3