(3R)-1-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(3-oxobenzo[f]chromen-1-yl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(3-oxo-1-benzo[f][1]benzopyranyl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(3-oxobenzo[f]chromen-1-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(3-ketobenzo[f]chromen-1-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C20H21N2O3+ MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C(=O)N

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C(=O)N

InChI

InChI=1S/C20H20N2O3/c21-20(24)14-5-3-9-22(11-14)12-15-10-18(23)25-17-8-7-13-4-1-2-6-16(13)19(15)17/h1-2,4,6-8,10,14H,3,5,9,11-12H2,(H2,21,24)/p+1/t14-/m1/s1