1-[(9Z)-9-[(3,4-dimethoxyphenyl)methylidene]fluoren-2-yl]-5-piperidin-1-ium-1-yl-pentan-1-one

Systemtic Name: 1-[(9Z)-9-[(3,4-dimethoxyphenyl)methylidene]fluoren-2-yl]-5-piperidin-1-ium-1-yl-pentan-1-one Openeye Name: 1-[(9Z)-9-[(3,4-dimethoxyphenyl)methylene]fluoren-2-yl]-5-piperidin-1-ium-1-yl-pentan-1-one CAS Name: 1-[(9Z)-9-[(3,4-dimethoxyphenyl)methylidene]-2-fluorenyl]-5-(1-piperidin-1-iumyl)-1-pentanone IUPAC Name: 1-[(9Z)-9-[(3,4-dimethoxyphenyl)methylidene]fluoren-2-yl]-5-piperidin-1-ium-1-ylpentan-1-one Traditional Name: 5-piperidin-1-ium-1-yl-1-[(9Z)-9-veratrylidenefluoren-2-yl]pentan-1-one Formula: C32H36NO3+ MolecularWeight: 482.63314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C3=CC=CC=C3C4=C2C=C(C=C4)C(=O)CCCC[NH+]5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C\2/C3=CC=CC=C3C4=C2C=C(C=C4)C(=O)CCCC[NH+]5CCCCC5)OC

InChI

InChI=1S/C32H35NO3/c1-35-31-16-13-23(21-32(31)36-2)20-28-26-11-5-4-10-25(26)27-15-14-24(22-29(27)28)30(34)12-6-9-19-33-17-7-3-8-18-33/h4-5,10-11,13-16,20-22H,3,6-9,12,17-19H2,1-2H3/p+1/b28-20-