N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-1-propylsulfonyl-nipecotamide Formula: C19H30N2O5S MolecularWeight: 398.5169

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCC2=CC(=C(C=C2)OCC)OC

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NCC2=CC(=C(C=C2)OCC)OC

InChI

InChI=1S/C19H30N2O5S/c1-4-11-27(23,24)21-10-6-7-16(14-21)19(22)20-13-15-8-9-17(26-5-2)18(12-15)25-3/h8-9,12,16H,4-7,10-11,13-14H2,1-3H3,(H,20,22)