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

Systemtic Name: 3-[4-(4-methoxyphenyl)piperidin-1-yl]-4-oxidanylidene-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal Openeye Name: 3-[4-(4-methoxyphenyl)-1-piperidyl]-4-oxo-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal CAS Name: 3-[4-(4-methoxyphenyl)-1-piperidinyl]-4-oxo-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal IUPAC Name: 3-[4-(4-methoxyphenyl)piperidin-1-yl]-4-oxo-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butanal Traditional Name: 4-keto-3-[4-(4-methoxyphenyl)piperidino]-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butyraldehyde Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCN(CC2)C(CC=O)C(=O)C3=CC4=C(CCNCC4)C=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2CCN(CC2)C(CC=O)C(=O)C3=CC4=C(CCNCC4)C=C3

InChI

InChI=1S/C26H32N2O3/c1-31-24-6-4-19(5-7-24)21-10-15-28(16-11-21)25(12-17-29)26(30)23-3-2-20-8-13-27-14-9-22(20)18-23/h2-7,17-18,21,25,27H,8-16H2,1H3