1-[4-(3-chloranyl-2-methoxy-phenyl)sulfanylbutyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine

Systemtic Name: 1-[4-(3-chloranyl-2-methoxy-phenyl)sulfanylbutyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine Openeye Name: 1-[4-(3-chloro-2-methoxy-phenyl)sulfanylbutyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine CAS Name: 1-[4-[(3-chloro-2-methoxyphenyl)thio]butyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine IUPAC Name: 1-[4-(3-chloro-2-methoxyphenyl)sulfanylbutyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine Traditional Name: 1-[4-[(3-chloro-2-methoxy-phenyl)thio]butyl]-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine Formula: C23H29ClN2O3S MolecularWeight: 449.00596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1Cl)SCCCCN2CCN(CC2)C3=C4C(=CC=C3)OCCO4

Isomeric SMILES

COC1=C(C=CC=C1Cl)SCCCCN2CCN(CC2)C3=C4C(=CC=C3)OCCO4

InChI

InChI=1S/C23H29ClN2O3S/c1-27-22-18(24)6-4-9-21(22)30-17-3-2-10-25-11-13-26(14-12-25)19-7-5-8-20-23(19)29-16-15-28-20/h4-9H,2-3,10-17H2,1H3