[1-(phenylmethyl)sulfonylpiperidin-4-yl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone

Systemtic Name: [1-(phenylmethyl)sulfonylpiperidin-4-yl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Openeye Name: (1-benzylsulfonyl-4-piperidyl)-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone CAS Name: [1-(phenylmethyl)sulfonyl-4-piperidinyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone IUPAC Name: (1-benzylsulfonylpiperidin-4-yl)-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Traditional Name: (1-benzylsulfonyl-4-piperidyl)-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C1)C(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C2=CC=CC=C2C1)C(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N2O3S/c26-23(25-15-7-6-11-20-10-4-5-12-22(20)25)21-13-16-24(17-14-21)29(27,28)18-19-8-2-1-3-9-19/h1-5,8-10,12,21H,6-7,11,13-18H2