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

Systemtic Name: (3S)-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(4-chloro-2-methoxy-5-methylphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(4-chloro-2-methoxy-5-methylphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(4-chloro-2-methoxy-5-methyl-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)[C@H]2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21ClN2O5/c1-12-7-16(18(27-2)10-15(12)22)23-21(26)13-8-20(25)24(11-13)14-3-4-17-19(9-14)29-6-5-28-17/h3-4,7,9-10,13H,5-6,8,11H2,1-2H3,(H,23,26)/t13-/m0/s1