N-heptan-2-yl-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-heptan-2-yl-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1-methylhexyl)-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-heptan-2-yl-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-heptan-2-yl-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(1-methylhexyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C21H32N2O3S MolecularWeight: 392.55538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCCCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H32N2O3S/c1-3-4-6-9-18(2)22-21(24)20-12-15-23(16-13-20)27(25,26)17-14-19-10-7-5-8-11-19/h5,7-8,10-11,14,17-18,20H,3-4,6,9,12-13,15-16H2,1-2H3,(H,22,24)/b17-14+