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

Systemtic Name: (3S)-1-(3-chloranyl-4-methyl-phenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(3-chloro-4-methyl-phenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(3-chloro-4-methylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(3-chloro-4-methylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(3-chloro-4-methyl-phenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=CC4=C(C=C3)OCCO4)Cl

InChI

InChI=1S/C20H19ClN2O4/c1-12-2-4-15(10-16(12)21)23-11-13(8-19(23)24)20(25)22-14-3-5-17-18(9-14)27-7-6-26-17/h2-5,9-10,13H,6-8,11H2,1H3,(H,22,25)/t13-/m0/s1