[(Z)-[azanyl-(4-methylphenyl)methylidene]amino] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: [(Z)-[azanyl-(4-methylphenyl)methylidene]amino] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: [(Z)-[amino(p-tolyl)methylene]amino] 1-(p-tolylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-4-piperidinecarboxylic acid [(Z)-[amino-(4-methylphenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(4-methylphenyl)methylidene]amino] 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-tosylisonipecotic acid [(Z)-[amino(p-tolyl)methylene]amino] ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N/OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)/N

InChI

InChI=1S/C21H25N3O4S/c1-15-3-7-17(8-4-15)20(22)23-28-21(25)18-11-13-24(14-12-18)29(26,27)19-9-5-16(2)6-10-19/h3-10,18H,11-14H2,1-2H3,(H2,22,23)