4-methylbenzenesulfonic acid; morpholin-4-yl-[4-(phenylmethyl)piperidin-4-yl]methanone

Systemtic Name: 4-methylbenzenesulfonic acid; morpholin-4-yl-[4-(phenylmethyl)piperidin-4-yl]methanone Openeye Name: (4-benzyl-4-piperidyl)-morpholino-methanone; 4-methylbenzenesulfonic acid CAS Name: 4-methylbenzenesulfonic acid; 4-morpholinyl-[4-(phenylmethyl)-4-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-4-yl)-morpholin-4-ylmethanone; 4-methylbenzenesulfonic acid Traditional Name: (4-benzyl-4-piperidyl)-morpholino-methanone; tosylic acid Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCCC1(CC2=CC=CC=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCCC1(CC2=CC=CC=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C17H24N2O2.C7H8O3S/c20-16(19-10-12-21-13-11-19)17(6-8-18-9-7-17)14-15-4-2-1-3-5-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-5,18H,6-14H2;2-5H,1H3,(H,8,9,10)