3-[1-[4-(4-bromanyl-3-methoxy-phenyl)piperazin-1-yl]ethyl]quinoline

Systemtic Name: 3-[1-[4-(4-bromanyl-3-methoxy-phenyl)piperazin-1-yl]ethyl]quinoline Openeye Name: 3-[1-[4-(4-bromo-3-methoxy-phenyl)piperazin-1-yl]ethyl]quinoline CAS Name: 3-[1-[4-(4-bromo-3-methoxyphenyl)-1-piperazinyl]ethyl]quinoline IUPAC Name: 3-[1-[4-(4-bromo-3-methoxyphenyl)piperazin-1-yl]ethyl]quinoline Traditional Name: 3-[1-[4-(4-bromo-3-methoxy-phenyl)piperazino]ethyl]quinoline Formula: C22H24BrN3O MolecularWeight: 426.34946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2N=C1)N3CCN(CC3)C4=CC(=C(C=C4)Br)OC

Isomeric SMILES

CC(C1=CC2=CC=CC=C2N=C1)N3CCN(CC3)C4=CC(=C(C=C4)Br)OC

InChI

InChI=1S/C22H24BrN3O/c1-16(18-13-17-5-3-4-6-21(17)24-15-18)25-9-11-26(12-10-25)19-7-8-20(23)22(14-19)27-2/h3-8,13-16H,9-12H2,1-2H3