(3S)-N-[(Z)-hexan-2-ylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(Z)-hexan-2-ylideneamino]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[(Z)-1-methylpentylideneamino]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[(Z)-hexan-2-ylideneamino]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(Z)-hexan-2-ylideneamino]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(Z)-1-methylpentylideneamino]-1-tosyl-nipecotamide Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCCC/C(=N\NC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C)/C

InChI

InChI=1S/C19H29N3O3S/c1-4-5-7-16(3)20-21-19(23)17-8-6-13-22(14-17)26(24,25)18-11-9-15(2)10-12-18/h9-12,17H,4-8,13-14H2,1-3H3,(H,21,23)/b20-16-/t17-/m0/s1