[(Z)-[2-phenyl-1-(phenylmethyl)piperidin-4-ylidene]amino] 4-methylbenzenesulfonate

Systemtic Name: [(Z)-[2-phenyl-1-(phenylmethyl)piperidin-4-ylidene]amino] 4-methylbenzenesulfonate Openeye Name: [(Z)-(1-benzyl-2-phenyl-4-piperidylidene)amino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(Z)-[2-phenyl-1-(phenylmethyl)-4-piperidinylidene]amino] ester IUPAC Name: [(Z)-(1-benzyl-2-phenylpiperidin-4-ylidene)amino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(Z)-(1-benzyl-2-phenyl-4-piperidylidene)amino] ester Formula: C25H26N2O3S MolecularWeight: 434.55054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON=C2CCN(C(C2)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/N=C\2/CCN(C(C2)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3S/c1-20-12-14-24(15-13-20)31(28,29)30-26-23-16-17-27(19-21-8-4-2-5-9-21)25(18-23)22-10-6-3-7-11-22/h2-15,25H,16-19H2,1H3/b26-23-