N-[4-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]phenyl]oxolane-2-carboxamide

Systemtic Name: N-[4-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]phenyl]oxolane-2-carboxamide Openeye Name: N-[4-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]phenyl]tetrahydrofuran-2-carboxamide CAS Name: N-[4-[[3-(3-bromo-4-methoxyphenyl)-1-oxopropyl]amino]phenyl]-2-oxolanecarboxamide IUPAC Name: N-[4-[3-(3-bromo-4-methoxyphenyl)propanoylamino]phenyl]oxolane-2-carboxamide Traditional Name: N-[4-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]phenyl]tetrahydrofuran-2-carboxamide Formula: C21H23BrN2O4 MolecularWeight: 447.32232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=O)C3CCCO3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=O)C3CCCO3)Br

InChI

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