1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(4-methoxyphenyl)piperazine

Systemtic Name: 1-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(4-methoxyphenyl)piperazine Openeye Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(4-methoxyphenyl)piperazine CAS Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(4-methoxyphenyl)piperazine IUPAC Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(4-methoxyphenyl)piperazine Traditional Name: 1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-(4-methoxyphenyl)piperazine Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CC3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C21H25ClN2O3/c1-25-18-5-3-17(4-6-18)24-9-7-23(8-10-24)15-16-13-19(22)21-20(14-16)26-11-2-12-27-21/h3-6,13-14H,2,7-12,15H2,1H3