1-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonyl-N-phenyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonyl-N-phenyl-pyrrolidine-2-carboxamide Openeye Name: 1-(3-bromo-4-ethoxy-5-methoxy-benzoyl)-N-phenyl-pyrrolidine-2-carboxamide CAS Name: 1-[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]-N-phenyl-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-bromo-4-ethoxy-5-methoxybenzoyl)-N-phenylpyrrolidine-2-carboxamide Traditional Name: 1-(3-bromo-4-ethoxy-5-methoxy-benzoyl)-N-phenyl-pyrrolidine-2-carboxamide Formula: C21H23BrN2O4 MolecularWeight: 447.32232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)N2CCCC2C(=O)NC3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N2CCCC2C(=O)NC3=CC=CC=C3)OC

InChI

InChI=1S/C21H23BrN2O4/c1-3-28-19-16(22)12-14(13-18(19)27-2)21(26)24-11-7-10-17(24)20(25)23-15-8-5-4-6-9-15/h4-6,8-9,12-13,17H,3,7,10-11H2,1-2H3,(H,23,25)