N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(2-amino-2-oxo-ethoxy)phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(2-amino-2-keto-ethoxy)phenyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)OCC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)OCC(=O)N

InChI

InChI=1S/C21H25N3O6S/c1-29-17-5-7-19(8-6-17)31(27,28)24-11-9-15(10-12-24)21(26)23-16-3-2-4-18(13-16)30-14-20(22)25/h2-8,13,15H,9-12,14H2,1H3,(H2,22,25)(H,23,26)