2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(E)-2-(4-ethoxyphenyl)vinyl]-5-(3-morpholin-4-ium-4-ylpropylamino)oxazole-4-carbonitrile CAS Name: 2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-[3-(4-morpholin-4-iumyl)propylamino]-4-oxazolecarbonitrile IUPAC Name: 2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-(3-morpholin-4-ium-4-ylpropylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-[(E)-2-p-phenetylvinyl]oxazole-4-carbonitrile Formula: C21H27N4O3+ MolecularWeight: 383.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC2=NC(=C(O2)NCCC[NH+]3CCOCC3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C2=NC(=C(O2)NCCC[NH+]3CCOCC3)C#N

InChI

InChI=1S/C21H26N4O3/c1-2-27-18-7-4-17(5-8-18)6-9-20-24-19(16-22)21(28-20)23-10-3-11-25-12-14-26-15-13-25/h4-9,23H,2-3,10-15H2,1H3/p+1/b9-6+