1-azanyl-4-[5-(4-cyclohexyloxybut-1-ynyl)thiophen-2-yl]-2-methyl-butan-1-ol; (E)-but-2-enedioic acid

Systemtic Name: 1-azanyl-4-[5-(4-cyclohexyloxybut-1-ynyl)thiophen-2-yl]-2-methyl-butan-1-ol; (E)-but-2-enedioic acid Openeye Name: 1-amino-4-[5-[4-(cyclohexoxy)but-1-ynyl]-2-thienyl]-2-methyl-butan-1-ol; fumaric acid CAS Name: 1-amino-4-[5-(4-cyclohexyloxybut-1-ynyl)-2-thiophenyl]-2-methyl-1-butanol; (E)-2-butenedioic acid IUPAC Name: 1-amino-4-[5-(4-cyclohexyloxybut-1-ynyl)thiophen-2-yl]-2-methylbutan-1-ol; (E)-but-2-enedioic acid Traditional Name: 1-amino-4-[5-[4-(cyclohexoxy)but-1-ynyl]-2-thienyl]-2-methyl-butan-1-ol; fumaric acid Formula: C23H33NO6S MolecularWeight: 451.57622

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C#CCCOC2CCCCC2)C(N)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CCC1=CC=C(S1)C#CCCOC2CCCCC2)C(N)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H29NO2S.C4H4O4/c1-15(19(20)21)10-11-18-13-12-17(23-18)9-5-6-14-22-16-7-3-2-4-8-16;5-3(6)1-2-4(7)8/h12-13,15-16,19,21H,2-4,6-8,10-11,14,20H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+