2-ethyl-1,3-dioxolane; (4Z)-4-[(E)-3-quinolin-1-ium-4-ylprop-2-enylidene]-1H-quinoline

Systemtic Name: 2-ethyl-1,3-dioxolane; (4Z)-4-[(E)-3-quinolin-1-ium-4-ylprop-2-enylidene]-1H-quinoline Openeye Name: 2-ethyl-1,3-dioxolane; (4Z)-4-[(E)-3-quinolin-1-ium-4-ylprop-2-enylidene]-1H-quinoline CAS Name: 2-ethyl-1,3-dioxolane; (4Z)-4-[(E)-3-(4-quinolin-1-iumyl)prop-2-enylidene]-1H-quinoline IUPAC Name: 2-ethyl-1,3-dioxolane; (4Z)-4-[(E)-3-quinolin-1-ium-4-ylprop-2-enylidene]-1H-quinoline Traditional Name: 2-ethyl-1,3-dioxolane; (4Z)-4-[(E)-3-quinolin-1-ium-4-ylprop-2-enylidene]-1H-quinoline Formula: C31H37N2O4+ MolecularWeight: 501.63648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1OCCO1.CCC1OCCO1.C1=CC=C2C(=C1)C(=CC=CC3=CC=[NH+]C4=CC=CC=C34)C=CN2

Isomeric SMILES

CCC1OCCO1.CCC1OCCO1.C1=CC=C2C(=C1)/C(=C\C=C\C3=CC=[NH+]C4=CC=CC=C34)/C=CN2

InChI

InChI=1S/C21H16N2.2C5H10O2/c1-3-10-20-18(8-1)16(12-14-22-20)6-5-7-17-13-15-23-21-11-4-2-9-19(17)21;2*1-2-5-6-3-4-7-5/h1-15,22H;2*5H,2-4H2,1H3/p+1/b7-5+,16-6-;;