(Z)-but-2-enedioic acid; (2Z)-N-[3-(4-methylpiperazin-1-yl)propoxy]-2-octylidene-cyclohexan-1-imine

Systemtic Name: (Z)-but-2-enedioic acid; (2Z)-N-[3-(4-methylpiperazin-1-yl)propoxy]-2-octylidene-cyclohexan-1-imine Openeye Name: maleic acid; (2Z)-N-[3-(4-methylpiperazin-1-yl)propoxy]-2-octylidene-cyclohexanimine CAS Name: (Z)-2-butenedioic acid; (2Z)-N-[3-(4-methyl-1-piperazinyl)propoxy]-2-octylidene-1-cyclohexanimine IUPAC Name: (Z)-but-2-enedioic acid; (2Z)-N-[3-(4-methylpiperazin-1-yl)propoxy]-2-octylidenecyclohexan-1-imine Traditional Name: maleic acid; (E)-3-(4-methylpiperazino)propoxy-[(2Z)-2-octylidenecyclohexylidene]amine Formula: C30H49N3O9 MolecularWeight: 595.72476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=C1CCCCC1=NOCCCN2CCN(CC2)C.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCC/C=C/1\C(=N\OCCCN2CCN(CC2)C)\CCCC1.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C22H41N3O.2C4H4O4/c1-3-4-5-6-7-8-12-21-13-9-10-14-22(21)23-26-20-11-15-25-18-16-24(2)17-19-25;2*5-3(6)1-2-4(7)8/h12H,3-11,13-20H2,1-2H3;2*1-2H,(H,5,6)(H,7,8)/b21-12-,23-22+;2*2-1-