3-(4-methoxyphenyl)-2-[4-(naphthalen-1-ylmethyl)morpholin-4-ium-4-yl]propanenitrile

Systemtic Name: 3-(4-methoxyphenyl)-2-[4-(naphthalen-1-ylmethyl)morpholin-4-ium-4-yl]propanenitrile Openeye Name: 3-(4-methoxyphenyl)-2-[4-(1-naphthylmethyl)morpholin-4-ium-4-yl]propanenitrile CAS Name: 3-(4-methoxyphenyl)-2-[4-(1-naphthalenylmethyl)-4-morpholin-4-iumyl]propanenitrile IUPAC Name: 3-(4-methoxyphenyl)-2-[4-(naphthalen-1-ylmethyl)morpholin-4-ium-4-yl]propanenitrile Traditional Name: 3-(4-methoxyphenyl)-2-[4-(1-naphthylmethyl)morpholin-4-ium-4-yl]propionitrile Formula: C25H27N2O2+ MolecularWeight: 387.49408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C#N)[N+]2(CCOCC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)CC(C#N)[N+]2(CCOCC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H27N2O2/c1-28-24-11-9-20(10-12-24)17-23(18-26)27(13-15-29-16-14-27)19-22-7-4-6-21-5-2-3-8-25(21)22/h2-12,23H,13-17,19H2,1H3/q+1