5-(oxan-4-yl)-2-[1-[[(E)-4-thiophen-2-ylbut-3-enoxy]amino]butylidene]cyclohexane-1,3-dione

Systemtic Name: 5-(oxan-4-yl)-2-[1-[[(E)-4-thiophen-2-ylbut-3-enoxy]amino]butylidene]cyclohexane-1,3-dione Openeye Name: 5-tetrahydropyran-4-yl-2-[1-[[(E)-4-(2-thienyl)but-3-enoxy]amino]butylidene]cyclohexane-1,3-dione CAS Name: 5-(4-oxanyl)-2-[1-[[(E)-4-thiophen-2-ylbut-3-enoxy]amino]butylidene]cyclohexane-1,3-dione IUPAC Name: 5-(oxan-4-yl)-2-[1-[[(E)-4-thiophen-2-ylbut-3-enoxy]amino]butylidene]cyclohexane-1,3-dione Traditional Name: 5-tetrahydropyran-4-yl-2-[1-[[(E)-4-(2-thienyl)but-3-enoxy]amino]butylidene]cyclohexane-1,3-quinone Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2CCOCC2)NOCCC=CC3=CC=CS3

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2CCOCC2)NOCC/C=C/C3=CC=CS3

InChI

InChI=1S/C23H31NO4S/c1-2-6-20(24-28-11-4-3-7-19-8-5-14-29-19)23-21(25)15-18(16-22(23)26)17-9-12-27-13-10-17/h3,5,7-8,14,17-18,24H,2,4,6,9-13,15-16H2,1H3/b7-3+,23-20?