(Z)-3-[4-[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]phenyl]but-2-enoic acid

Systemtic Name: (Z)-3-[4-[3-(4-methylpiperazin-1-yl)-2-oxidanyl-propoxy]phenyl]but-2-enoic acid Openeye Name: (Z)-3-[4-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl]but-2-enoic acid CAS Name: (Z)-3-[4-[2-hydroxy-3-(4-methyl-1-piperazinyl)propoxy]phenyl]-2-butenoic acid IUPAC Name: (Z)-3-[4-[2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]phenyl]but-2-enoic acid Traditional Name: (Z)-3-[4-[2-hydroxy-3-(4-methylpiperazino)propoxy]phenyl]but-2-enoic acid Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C)O

Isomeric SMILES

C/C(=C/C(=O)O)/C1=CC=C(C=C1)OCC(CN2CCN(CC2)C)O

InChI

InChI=1S/C18H26N2O4/c1-14(11-18(22)23)15-3-5-17(6-4-15)24-13-16(21)12-20-9-7-19(2)8-10-20/h3-6,11,16,21H,7-10,12-13H2,1-2H3,(H,22,23)/b14-11-