(6-chloranyl-3,4-dihydro-2H-chromen-3-yl)-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (6-chloranyl-3,4-dihydro-2H-chromen-3-yl)-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]methanone Openeye Name: [4-(4-chlorobenzoyl)piperazin-1-yl]-(6-chlorochroman-3-yl)methanone CAS Name: (6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl)-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: [4-(4-chlorobenzoyl)piperazin-1-yl]-(6-chloro-3,4-dihydro-2H-chromen-3-yl)methanone Traditional Name: [4-(4-chlorobenzoyl)piperazino]-(6-chlorochroman-3-yl)methanone Formula: C21H20Cl2N2O3 MolecularWeight: 419.3011

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CC3=C(C=CC(=C3)Cl)OC2)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2CC3=C(C=CC(=C3)Cl)OC2)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20Cl2N2O3/c22-17-3-1-14(2-4-17)20(26)24-7-9-25(10-8-24)21(27)16-11-15-12-18(23)5-6-19(15)28-13-16/h1-6,12,16H,7-11,13H2