4-(2-piperidin-1-ium-1-ylethylamino)chromen-2-one

Systemtic Name: 4-(2-piperidin-1-ium-1-ylethylamino)chromen-2-one Openeye Name: 4-(2-piperidin-1-ium-1-ylethylamino)chromen-2-one CAS Name: 4-[2-(1-piperidin-1-iumyl)ethylamino]-1-benzopyran-2-one IUPAC Name: 4-(2-piperidin-1-ium-1-ylethylamino)chromen-2-one Traditional Name: 4-(2-piperidin-1-ium-1-ylethylamino)coumarin Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC2=CC(=O)OC3=CC=CC=C32

Isomeric SMILES

C1CC[NH+](CC1)CCNC2=CC(=O)OC3=CC=CC=C32

InChI

InChI=1S/C16H20N2O2/c19-16-12-14(13-6-2-3-7-15(13)20-16)17-8-11-18-9-4-1-5-10-18/h2-3,6-7,12,17H,1,4-5,8-11H2/p+1