2-[4-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]piperazine-1,4-diium-1-yl]ethanol

Systemtic Name: 2-[4-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]piperazine-1,4-diium-1-yl]ethanol Openeye Name: 2-[4-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]piperazine-1,4-diium-1-yl]ethanol CAS Name: 2-[4-[2-(3,4-dimethoxyphenyl)-1-benzopyran-4-ylidene]-1-piperazine-1,4-diiumyl]ethanol IUPAC Name: 2-[4-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]piperazine-1,4-diium-1-yl]ethanol Traditional Name: 2-[4-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]piperazine-1,4-diium-1-yl]ethanol Formula: C23H28N2O4+2 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=[N+]3CC[NH+](CC3)CCO)C4=CC=CC=C4O2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=[N+]3CC[NH+](CC3)CCO)C4=CC=CC=C4O2)OC

InChI

InChI=1S/C23H27N2O4/c1-27-21-8-7-17(15-23(21)28-2)22-16-19(18-5-3-4-6-20(18)29-22)25-11-9-24(10-12-25)13-14-26/h3-8,15-16,26H,9-14H2,1-2H3/q+1/p+1