(3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-ethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-ethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-ethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H22N2O4/c1-2-14-3-6-17(7-4-14)23-13-15(11-20(23)24)21(25)22-16-5-8-18-19(12-16)27-10-9-26-18/h3-8,12,15H,2,9-11,13H2,1H3,(H,22,25)/t15-/m0/s1