(Z)-but-2-enedioic acid; 1-(4-hexylpiperazin-1-yl)-N-(2-methylpropyl)-1-phenyl-methanimine

Systemtic Name: (Z)-but-2-enedioic acid; 1-(4-hexylpiperazin-1-yl)-N-(2-methylpropyl)-1-phenyl-methanimine Openeye Name: 1-(4-hexylpiperazin-1-yl)-N-isobutyl-1-phenyl-methanimine; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-(4-hexyl-1-piperazinyl)-N-(2-methylpropyl)-1-phenylmethanimine IUPAC Name: (Z)-but-2-enedioic acid; 1-(4-hexylpiperazin-1-yl)-N-(2-methylpropyl)-1-phenylmethanimine Traditional Name: [(4-hexylpiperazino)-phenyl-methylene]-isobutyl-amine; maleic acid Formula: C29H43N3O8 MolecularWeight: 561.66702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCN(CC1)C(=NCC(C)C)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCN1CCN(CC1)C(=NCC(C)C)C2=CC=CC=C2.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C21H35N3.2C4H4O4/c1-4-5-6-10-13-23-14-16-24(17-15-23)21(22-18-19(2)3)20-11-8-7-9-12-20;2*5-3(6)1-2-4(7)8/h7-9,11-12,19H,4-6,10,13-18H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-