6-bromanyl-3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-chromen-2-one

Systemtic Name: 6-bromanyl-3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6-bromo-3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 6-bromo-3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 6-bromo-3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]coumarin Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O

InChI

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