N-[(E)-3-methylbutylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(E)-3-methylbutylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(E)-3-methylbutylideneamino]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(E)-3-methylbutylideneamino]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(E)-3-methylbutylideneamino]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(E)-3-methylbutylideneamino]-1-tosyl-isonipecotamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NN=CCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N/N=C/CC(C)C

InChI

InChI=1S/C18H27N3O3S/c1-14(2)8-11-19-20-18(22)16-9-12-21(13-10-16)25(23,24)17-6-4-15(3)5-7-17/h4-7,11,14,16H,8-10,12-13H2,1-3H3,(H,20,22)/b19-11+