[(Z)-[azanyl-(3-methylphenyl)methylidene]amino] 1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: [(Z)-[azanyl-(3-methylphenyl)methylidene]amino] 1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: [(Z)-[amino(m-tolyl)methylene]amino] 1-(benzenesulfonyl)piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-piperidinecarboxylic acid [(Z)-[amino-(3-methylphenyl)methylidene]amino] ester IUPAC Name: [(Z)-[amino-(3-methylphenyl)methylidene]amino] 1-(benzenesulfonyl)piperidine-4-carboxylate Traditional Name: 1-besylisonipecotic acid [(Z)-[amino(m-tolyl)methylene]amino] ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4S/c1-15-6-5-7-17(14-15)19(21)22-27-20(24)16-10-12-23(13-11-16)28(25,26)18-8-3-2-4-9-18/h2-9,14,16H,10-13H2,1H3,(H2,21,22)