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

Systemtic Name: 3-[4-(4-methylphenyl)piperidin-1-yl]-4-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-oxidanylidene-butanal Openeye Name: 4-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-oxo-3-[4-(p-tolyl)-1-piperidyl]butanal CAS Name: 3-[4-(4-methylphenyl)-1-piperidinyl]-4-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-oxobutanal IUPAC Name: 3-[4-(4-methylphenyl)piperidin-1-yl]-4-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-4-oxobutanal Traditional Name: 4-keto-4-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-3-[4-(p-tolyl)piperidino]butyraldehyde Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCN(CC2)C(CC=O)C(=O)C3=CC4=C(CCN(CC4)C)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2CCN(CC2)C(CC=O)C(=O)C3=CC4=C(CCN(CC4)C)C=C3

InChI

InChI=1S/C27H34N2O2/c1-20-3-5-21(6-4-20)23-11-16-29(17-12-23)26(13-18-30)27(31)25-8-7-22-9-14-28(2)15-10-24(22)19-25/h3-8,18-19,23,26H,9-17H2,1-2H3