(3-bromanyl-4-ethoxy-5-methoxy-phenyl)-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-4-ethoxy-5-methoxy-phenyl)-[4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)-[4-[(5-chloro-2-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (3-bromo-4-ethoxy-5-methoxyphenyl)-[4-[(5-chloro-2-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-bromo-4-ethoxy-5-methoxyphenyl)-[4-[(5-chloro-2-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)-[4-(5-chloro-2-methoxy-benzyl)piperazino]methanone Formula: C22H26BrClN2O4 MolecularWeight: 497.80984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)CC3=C(C=CC(=C3)Cl)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)N2CCN(CC2)CC3=C(C=CC(=C3)Cl)OC)OC

InChI

InChI=1S/C22H26BrClN2O4/c1-4-30-21-18(23)12-15(13-20(21)29-3)22(27)26-9-7-25(8-10-26)14-16-11-17(24)5-6-19(16)28-2/h5-6,11-13H,4,7-10,14H2,1-3H3