[4-[(7-bromanyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]-(4-ethylphenyl)methanone

Systemtic Name: [4-[(7-bromanyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]-(4-ethylphenyl)methanone Openeye Name: [4-(7-bromobenzofuran-2-carbonyl)piperazin-1-yl]-(4-ethylphenyl)methanone CAS Name: [4-[(7-bromo-2-benzofuranyl)-oxomethyl]-1-piperazinyl]-(4-ethylphenyl)methanone IUPAC Name: [4-(7-bromo-1-benzofuran-2-carbonyl)piperazin-1-yl]-(4-ethylphenyl)methanone Traditional Name: [4-(7-bromobenzofuran-2-carbonyl)piperazino]-(4-ethylphenyl)methanone Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

InChI

InChI=1S/C22H21BrN2O3/c1-2-15-6-8-16(9-7-15)21(26)24-10-12-25(13-11-24)22(27)19-14-17-4-3-5-18(23)20(17)28-19/h3-9,14H,2,10-13H2,1H3