[2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Openeye Name: [6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium CAS Name: [6-hydroxy-2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)azanium Traditional Name: [6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ammonium Formula: C25H32N2O3+2 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)[NH+]=C2C=C(OC3=C2C=C(C=C3)O)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)[NH+]=C2C=C(OC3=C2C=C(C=C3)O)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C25H30N2O3/c1-24(2)14-17(15-25(3,4)27-24)26-21-13-23(16-6-9-19(29-5)10-7-16)30-22-11-8-18(28)12-20(21)22/h6-13,17,27-28H,14-15H2,1-5H3/p+2