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

Systemtic Name: 6-bromanyl-3-[4-(4-methylphenyl)piperazin-1-yl]carbonyl-chromen-2-one Openeye Name: 6-bromo-3-[4-(p-tolyl)piperazine-1-carbonyl]chromen-2-one CAS Name: 6-bromo-3-[[4-(4-methylphenyl)-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[4-(4-methylphenyl)piperazine-1-carbonyl]chromen-2-one Traditional Name: 6-bromo-3-[4-(p-tolyl)piperazine-1-carbonyl]coumarin Formula: C21H19BrN2O3 MolecularWeight: 427.29116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN2O3/c1-14-2-5-17(6-3-14)23-8-10-24(11-9-23)20(25)18-13-15-12-16(22)4-7-19(15)27-21(18)26/h2-7,12-13H,8-11H2,1H3