1-[2-ethoxy-5-[(E)-prop-1-enyl]phenoxy]-5-phenyl-5-pyridin-1-ium-1-yl-pentan-2-ol

Systemtic Name: 1-[2-ethoxy-5-[(E)-prop-1-enyl]phenoxy]-5-phenyl-5-pyridin-1-ium-1-yl-pentan-2-ol Openeye Name: 1-[2-ethoxy-5-[(E)-prop-1-enyl]phenoxy]-5-phenyl-5-pyridin-1-ium-1-yl-pentan-2-ol CAS Name: 1-[2-ethoxy-5-[(E)-prop-1-enyl]phenoxy]-5-phenyl-5-(1-pyridin-1-iumyl)-2-pentanol IUPAC Name: 1-[2-ethoxy-5-[(E)-prop-1-enyl]phenoxy]-5-phenyl-5-pyridin-1-ium-1-ylpentan-2-ol Traditional Name: 1-[2-ethoxy-5-[(E)-prop-1-enyl]phenoxy]-5-phenyl-5-pyridin-1-ium-1-yl-pentan-2-ol Formula: C27H32NO3+ MolecularWeight: 418.54788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC)OCC(CCC(C2=CC=CC=C2)[N+]3=CC=CC=C3)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C)OCC(CCC(C2=CC=CC=C2)[N+]3=CC=CC=C3)O

InChI

InChI=1S/C27H32NO3/c1-3-11-22-14-17-26(30-4-2)27(20-22)31-21-24(29)15-16-25(23-12-7-5-8-13-23)28-18-9-6-10-19-28/h3,5-14,17-20,24-25,29H,4,15-16,21H2,1-2H3/q+1/b11-3+