2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-oxidanylidene-3-phenyl-chromen-2-yl)ethanamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-oxidanylidene-3-phenyl-chromen-2-yl)ethanamide Openeye Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-oxo-3-phenyl-chromen-2-yl)acetamide CAS Name: 2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-(4-oxo-3-phenyl-1-benzopyran-2-yl)acetamide IUPAC Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(4-oxo-3-phenylchromen-2-yl)acetamide Traditional Name: N-(4-keto-3-phenyl-chromen-2-yl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C23H25N2O3+ MolecularWeight: 377.4562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=C(C(=O)C3=CC=CC=C3O2)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)NC2=C(C(=O)C3=CC=CC=C3O2)C4=CC=CC=C4

InChI

InChI=1S/C23H24N2O3/c1-16-8-7-13-25(14-16)15-20(26)24-23-21(17-9-3-2-4-10-17)22(27)18-11-5-6-12-19(18)28-23/h2-6,9-12,16H,7-8,13-15H2,1H3,(H,24,26)/p+1/t16-/m0/s1