6-chloranyl-7-methyl-4-[[4-(3-methylphenyl)piperazin-1-yl]methyl]chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-[[4-(3-methylphenyl)piperazin-1-yl]methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[[4-(m-tolyl)piperazin-1-yl]methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[[4-(3-methylphenyl)-1-piperazinyl]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[[4-(3-methylphenyl)piperazin-1-yl]methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[[4-(m-tolyl)piperazino]methyl]coumarin Formula: C22H23ClN2O2 MolecularWeight: 382.88322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC3=CC(=O)OC4=CC(=C(C=C34)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CC3=CC(=O)OC4=CC(=C(C=C34)Cl)C

InChI

InChI=1S/C22H23ClN2O2/c1-15-4-3-5-18(10-15)25-8-6-24(7-9-25)14-17-12-22(26)27-21-11-16(2)20(23)13-19(17)21/h3-5,10-13H,6-9,14H2,1-2H3