N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-fluoranyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-fluoranyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-fluoro-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-fluorobenzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-fluorobenzamide Traditional Name: 3-fluoro-N-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-N-piperonyl-benzamide Formula: C27H23FN2O4 MolecularWeight: 458.480923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC4=C(C=C3)OCO4)C(=O)C5=CC(=CC=C5)F)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC4=C(C=C3)OCO4)C(=O)C5=CC(=CC=C5)F)C

InChI

InChI=1S/C27H23FN2O4/c1-16-8-17(2)22-12-20(26(31)29-23(22)9-16)14-30(27(32)19-4-3-5-21(28)11-19)13-18-6-7-24-25(10-18)34-15-33-24/h3-12H,13-15H2,1-2H3,(H,29,31)