9,10-bis(oxidanylidene)-4-[(E)-4-oxidanylnon-2-enoxy]-3-propyl-anthracene-1-carbonitrile

Systemtic Name: 9,10-bis(oxidanylidene)-4-[(E)-4-oxidanylnon-2-enoxy]-3-propyl-anthracene-1-carbonitrile Openeye Name: 4-[(E)-4-hydroxynon-2-enoxy]-9,10-dioxo-3-propyl-anthracene-1-carbonitrile CAS Name: 4-[(E)-4-hydroxynon-2-enoxy]-9,10-dioxo-3-propyl-1-anthracenecarbonitrile IUPAC Name: 4-[(E)-4-hydroxynon-2-enoxy]-9,10-dioxo-3-propylanthracene-1-carbonitrile Traditional Name: 4-[(E)-4-hydroxynon-2-enoxy]-9,10-diketo-3-propyl-anthracene-1-carbonitrile Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CCOC1=C(C=C(C2=C1C(=O)C3=CC=CC=C3C2=O)C#N)CCC)O

Isomeric SMILES

CCCCCC(/C=C/COC1=C(C=C(C2=C1C(=O)C3=CC=CC=C3C2=O)C#N)CCC)O

InChI

InChI=1S/C27H29NO4/c1-3-5-6-11-20(29)12-9-15-32-27-18(10-4-2)16-19(17-28)23-24(27)26(31)22-14-8-7-13-21(22)25(23)30/h7-9,12-14,16,20,29H,3-6,10-11,15H2,1-2H3/b12-9+