ethyl 1-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-[(E)-styryl]sulfonylpiperidine-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-[(E)-styryl]sulfonylisonipecotoyl]isonipecotic acid ethyl ester Formula: C22H30N2O5S MolecularWeight: 434.549

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H30N2O5S/c1-2-29-22(26)20-8-13-23(14-9-20)21(25)19-10-15-24(16-11-19)30(27,28)17-12-18-6-4-3-5-7-18/h3-7,12,17,19-20H,2,8-11,13-16H2,1H3/b17-12+