(3S)-N-[(Z)-(4-methoxy-3-oxidanyl-phenyl)methylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(Z)-(4-methoxy-3-oxidanyl-phenyl)methylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[(Z)-(3-hydroxy-4-methoxy-phenyl)methyleneamino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[(Z)-(3-hydroxy-4-methoxyphenyl)methylideneamino]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(Z)-(3-hydroxy-4-methoxyphenyl)methylideneamino]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(Z)-(3-hydroxy-4-methoxy-benzylidene)amino]-1-tosyl-nipecotamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NN=CC3=CC(=C(C=C3)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)N/N=C\C3=CC(=C(C=C3)OC)O

InChI

InChI=1S/C21H25N3O5S/c1-15-5-8-18(9-6-15)30(27,28)24-11-3-4-17(14-24)21(26)23-22-13-16-7-10-20(29-2)19(25)12-16/h5-10,12-13,17,25H,3-4,11,14H2,1-2H3,(H,23,26)/b22-13-/t17-/m0/s1