(3S)-N-(5-chloranyl-2-methoxy-phenyl)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(5-chloranyl-2-methoxy-phenyl)-1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(5-chloro-2-methoxy-phenyl)-1-(2,6-diethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(5-chloro-2-methoxyphenyl)-1-(2,6-diethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(5-chloro-2-methoxyphenyl)-1-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(5-chloro-2-methoxy-phenyl)-1-(2,6-diethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2CC(CC2=O)C(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClN2O3/c1-4-14-7-6-8-15(5-2)21(14)25-13-16(11-20(25)26)22(27)24-18-12-17(23)9-10-19(18)28-3/h6-10,12,16H,4-5,11,13H2,1-3H3,(H,24,27)/t16-/m0/s1