1-(2-bromophenyl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(2-bromophenyl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(2-bromophenyl)-N-[(3-methoxy-4-propoxyphenyl)methyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-[(3-methoxy-4-propoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(2-bromophenyl)-5-keto-N-(3-methoxy-4-propoxy-benzyl)pyrrolidine-3-carboxamide Formula: C22H25BrN2O4 MolecularWeight: 461.3489

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC(=O)C2CC(=O)N(C2)C3=CC=CC=C3Br)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC(=O)C2CC(=O)N(C2)C3=CC=CC=C3Br)OC

InChI

InChI=1S/C22H25BrN2O4/c1-3-10-29-19-9-8-15(11-20(19)28-2)13-24-22(27)16-12-21(26)25(14-16)18-7-5-4-6-17(18)23/h4-9,11,16H,3,10,12-14H2,1-2H3,(H,24,27)