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

Systemtic Name: 2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(E)-2-(4-ethoxyphenyl)vinyl]-5-(2-morpholin-4-ium-4-ylethylamino)oxazole-4-carbonitrile CAS Name: 2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-[2-(4-morpholin-4-iumyl)ethylamino]-4-oxazolecarbonitrile IUPAC Name: 2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-(2-morpholin-4-ium-4-ylethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(2-morpholin-4-ium-4-ylethylamino)-2-[(E)-2-p-phenetylvinyl]oxazole-4-carbonitrile Formula: C20H25N4O3+ MolecularWeight: 369.4375

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O3/c1-2-26-17-6-3-16(4-7-17)5-8-19-23-18(15-21)20(27-19)22-9-10-24-11-13-25-14-12-24/h3-8,22H,2,9-14H2,1H3/p+1/b8-5+