(E)-but-2-enedioic acid; 4-(cyclohexylamino)-1-naphthalen-1-yloxy-butan-2-ol

Systemtic Name: (E)-but-2-enedioic acid; 4-(cyclohexylamino)-1-naphthalen-1-yloxy-butan-2-ol Openeye Name: 4-(cyclohexylamino)-1-(1-naphthyloxy)butan-2-ol; fumaric acid CAS Name: (E)-2-butenedioic acid; 4-(cyclohexylamino)-1-(1-naphthalenyloxy)-2-butanol IUPAC Name: (E)-but-2-enedioic acid; 4-(cyclohexylamino)-1-naphthalen-1-yloxybutan-2-ol Traditional Name: 4-(cyclohexylamino)-1-(1-naphthoxy)butan-2-ol; fumaric acid Formula: C24H31NO6 MolecularWeight: 429.50604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCCC(COC2=CC=CC3=CC=CC=C32)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)NCCC(COC2=CC=CC3=CC=CC=C32)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C20H27NO2.C4H4O4/c22-18(13-14-21-17-9-2-1-3-10-17)15-23-20-12-6-8-16-7-4-5-11-19(16)20;5-3(6)1-2-4(7)8/h4-8,11-12,17-18,21-22H,1-3,9-10,13-15H2;1-2H,(H,5,6)(H,7,8)/b;2-1+