[4-[(5-bromanyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]-(4-ethylphenyl)methanone

Systemtic Name: [4-[(5-bromanyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]-(4-ethylphenyl)methanone Openeye Name: [4-(5-bromobenzofuran-2-carbonyl)piperazin-1-yl]-(4-ethylphenyl)methanone CAS Name: [4-[(5-bromo-2-benzofuranyl)-oxomethyl]-1-piperazinyl]-(4-ethylphenyl)methanone IUPAC Name: [4-(5-bromo-1-benzofuran-2-carbonyl)piperazin-1-yl]-(4-ethylphenyl)methanone Traditional Name: [4-(5-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/c1-2-15-3-5-16(6-4-15)21(26)24-9-11-25(12-10-24)22(27)20-14-17-13-18(23)7-8-19(17)28-20/h3-8,13-14H,2,9-12H2,1H3