N,N-dimethyl-1-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N,N-dimethyl-1-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N,N-dimethyl-1-[(3-oxobenzo[f]chromen-1-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N,N-dimethyl-1-[(3-oxo-1-benzo[f][1]benzopyranyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N,N-dimethyl-1-[(3-oxobenzo[f]chromen-1-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(3-ketobenzo[f]chromen-1-yl)methyl]-N,N-dimethyl-piperidin-1-ium-4-carboxamide Formula: C22H25N2O3+ MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CC[NH+](CC1)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

CN(C)C(=O)C1CC[NH+](CC1)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24N2O3/c1-23(2)22(26)16-9-11-24(12-10-16)14-17-13-20(25)27-19-8-7-15-5-3-4-6-18(15)21(17)19/h3-8,13,16H,9-12,14H2,1-2H3/p+1