(Z)-but-2-enedioic acid; 1-(N'-dodecylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonyl-guanidine

Systemtic Name: (Z)-but-2-enedioic acid; 1-(N'-dodecylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonyl-guanidine Openeye Name: 1-(N'-dodecylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonyl-guanidine; maleic acid CAS Name: 1-[amino(dodecylimino)methyl]-2-(4-propoxyphenyl)sulfonylguanidine; (Z)-2-butenedioic acid IUPAC Name: (Z)-but-2-enedioic acid; 1-(N'-dodecylcarbamimidoyl)-2-(4-propoxyphenyl)sulfonylguanidine Traditional Name: 1-(N'-laurylamidino)-2-(4-propoxyphenyl)sulfonyl-guanidine; maleic acid Formula: C27H45N5O7S MolecularWeight: 583.7405

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN=C(N)NC(=NS(=O)(=O)C1=CC=C(C=C1)OCCC)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCN=C(N)NC(=NS(=O)(=O)C1=CC=C(C=C1)OCCC)N.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C23H41N5O3S.C4H4O4/c1-3-5-6-7-8-9-10-11-12-13-18-26-22(24)27-23(25)28-32(29,30)21-16-14-20(15-17-21)31-19-4-2;5-3(6)1-2-4(7)8/h14-17H,3-13,18-19H2,1-2H3,(H5,24,25,26,27,28);1-2H,(H,5,6)(H,7,8)/b;2-1-