2-[[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]methyl]chromen-4-one

Systemtic Name: 2-[[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]methyl]chromen-4-one Openeye Name: 2-[[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]methyl]chromen-4-one CAS Name: 2-[[4-[(3,4-dichlorophenyl)methyl]-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 2-[[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]methyl]chromen-4-one Traditional Name: 2-[[4-(3,4-dichlorobenzyl)piperazino]methyl]chromone Formula: C21H20Cl2N2O2 MolecularWeight: 403.3017

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)CC3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)CC3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C21H20Cl2N2O2/c22-18-6-5-15(11-19(18)23)13-24-7-9-25(10-8-24)14-16-12-20(26)17-3-1-2-4-21(17)27-16/h1-6,11-12H,7-10,13-14H2