[[1-(phenylsulfonyl)piperidin-4-ylidene]amino] 4-methylbenzenesulfonate

Systemtic Name: [[1-(phenylsulfonyl)piperidin-4-ylidene]amino] 4-methylbenzenesulfonate Openeye Name: [[1-(benzenesulfonyl)-4-piperidylidene]amino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [[1-(benzenesulfonyl)-4-piperidinylidene]amino] ester IUPAC Name: [[1-(benzenesulfonyl)piperidin-4-ylidene]amino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1-besyl-4-piperidylidene)amino] ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON=C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ON=C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O5S2/c1-15-7-9-18(10-8-15)27(23,24)25-19-16-11-13-20(14-12-16)26(21,22)17-5-3-2-4-6-17/h2-10H,11-14H2,1H3