5-(3-morpholin-4-ium-4-ylpropylamino)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(4-propoxyphenyl)oxazole-4-carbonitrile CAS Name: 5-[3-(4-morpholin-4-iumyl)propylamino]-2-(4-propoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3-morpholin-4-ium-4-ylpropylamino)-2-(4-propoxyphenyl)oxazole-4-carbonitrile Formula: C20H27N4O3+ MolecularWeight: 371.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC(=C(O2)NCCC[NH+]3CCOCC3)C#N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC(=C(O2)NCCC[NH+]3CCOCC3)C#N

InChI

InChI=1S/C20H26N4O3/c1-2-12-26-17-6-4-16(5-7-17)19-23-18(15-21)20(27-19)22-8-3-9-24-10-13-25-14-11-24/h4-7,22H,2-3,8-14H2,1H3/p+1