N-[2-(3,4-dimethoxyphenyl)ethyl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-naphthylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-naphthalenylsulfonyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-naphthalen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-homoveratryl-1-(2-naphthylsulfonyl)pyrrolidine-2-carboxamide Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2CCCN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2CCCN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C25H28N2O5S/c1-31-23-12-9-18(16-24(23)32-2)13-14-26-25(28)22-8-5-15-27(22)33(29,30)21-11-10-19-6-3-4-7-20(19)17-21/h3-4,6-7,9-12,16-17,22H,5,8,13-15H2,1-2H3,(H,26,28)