[2-(4-methoxyphenyl)chromen-4-ylidene]-(4-methylpiperazin-4-ium-1-yl)azanium

Systemtic Name: [2-(4-methoxyphenyl)chromen-4-ylidene]-(4-methylpiperazin-4-ium-1-yl)azanium Openeye Name: [2-(4-methoxyphenyl)chromen-4-ylidene]-(4-methylpiperazin-4-ium-1-yl)ammonium CAS Name: [2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]-(4-methyl-1-piperazin-4-iumyl)ammonium IUPAC Name: [2-(4-methoxyphenyl)chromen-4-ylidene]-(4-methylpiperazin-4-ium-1-yl)azanium Traditional Name: [2-(4-methoxyphenyl)chromen-4-ylidene]-(4-methylpiperazin-4-ium-1-yl)ammonium Formula: C21H25N3O2+2 MolecularWeight: 351.4421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)[NH+]=C2C=C(OC3=CC=CC=C32)C4=CC=C(C=C4)OC

Isomeric SMILES

C[NH+]1CCN(CC1)[NH+]=C2C=C(OC3=CC=CC=C32)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H23N3O2/c1-23-11-13-24(14-12-23)22-19-15-21(16-7-9-17(25-2)10-8-16)26-20-6-4-3-5-18(19)20/h3-10,15H,11-14H2,1-2H3/p+2