(5-bromanyl-2-dodecoxy-phenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride

Systemtic Name: (5-bromanyl-2-dodecoxy-phenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride Openeye Name: (5-bromo-2-dodecoxy-phenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride CAS Name: (5-bromo-2-dodecoxyphenyl)-(4-methyl-1-piperazinyl)methanone hydrochloride IUPAC Name: (5-bromo-2-dodecoxyphenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride Traditional Name: (5-bromo-2-lauryloxy-phenyl)-(4-methylpiperazino)methanone hydrochloride Formula: C24H40BrClN2O2 MolecularWeight: 503.9436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)Br)C(=O)N2CCN(CC2)C.Cl

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)Br)C(=O)N2CCN(CC2)C.Cl

InChI

InChI=1S/C24H39BrN2O2.ClH/c1-3-4-5-6-7-8-9-10-11-12-19-29-23-14-13-21(25)20-22(23)24(28)27-17-15-26(2)16-18-27;/h13-14,20H,3-12,15-19H2,1-2H3;1H