[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methanone

Systemtic Name: [4-(4-chlorophenyl)carbonylpiperazin-1-yl]-(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methanone Openeye Name: [4-(4-chlorobenzoyl)piperazin-1-yl]-(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methanone CAS Name: [4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methanone IUPAC Name: [4-(4-chlorobenzoyl)piperazin-1-yl]-(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methanone Traditional Name: [4-(4-chlorobenzoyl)piperazino]-(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)methanone Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC=CC=C2O1)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1C(OC2=CC=CC=C2O1)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN2O4/c1-14-19(28-18-5-3-2-4-17(18)27-14)21(26)24-12-10-23(11-13-24)20(25)15-6-8-16(22)9-7-15/h2-9,14,19H,10-13H2,1H3