N-[1-(4-ethoxyphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[1-(4-ethoxyphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[1-(4-ethoxyphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(4-ethoxyphenyl)ethyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[1-(4-ethoxyphenyl)ethyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: 1-(3-phenylpropylsulfonyl)-N-(1-p-phenetylethyl)isonipecotamide Formula: C25H34N2O4S MolecularWeight: 458.61346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C25H34N2O4S/c1-3-31-24-13-11-22(12-14-24)20(2)26-25(28)23-15-17-27(18-16-23)32(29,30)19-7-10-21-8-5-4-6-9-21/h4-6,8-9,11-14,20,23H,3,7,10,15-19H2,1-2H3,(H,26,28)