(3-bromanyl-4-hexoxy-phenyl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-bromanyl-4-hexoxy-phenyl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(3-bromo-4-hexoxy-phenyl)methanone CAS Name: (3-bromo-4-hexoxyphenyl)-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(3-bromo-4-hexoxyphenyl)methanone Traditional Name: (4-benzylpiperazino)-(3-bromo-4-hexoxy-phenyl)methanone Formula: C24H31BrN2O2 MolecularWeight: 459.41914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C24H31BrN2O2/c1-2-3-4-8-17-29-23-12-11-21(18-22(23)25)24(28)27-15-13-26(14-16-27)19-20-9-6-5-7-10-20/h5-7,9-12,18H,2-4,8,13-17,19H2,1H3