(2S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-phenoxyethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-phenoxyethyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-phenoxyethyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-phenoxyethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-phenoxyethyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(2,5-dimethoxyphenyl)sulfonyl-N-(2-phenoxyethyl)pyrrolidine-2-carboxamide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCC2C(=O)NCCOC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC[C@H]2C(=O)NCCOC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O6S/c1-27-17-10-11-19(28-2)20(15-17)30(25,26)23-13-6-9-18(23)21(24)22-12-14-29-16-7-4-3-5-8-16/h3-5,7-8,10-11,15,18H,6,9,12-14H2,1-2H3,(H,22,24)/t18-/m0/s1