4-[(4-methylpiperidin-1-ium-1-yl)methyl]-6-oxidanyl-chromen-2-one

Systemtic Name: 4-[(4-methylpiperidin-1-ium-1-yl)methyl]-6-oxidanyl-chromen-2-one Openeye Name: 6-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one CAS Name: 6-hydroxy-4-[(4-methyl-1-piperidin-1-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 6-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one Traditional Name: 6-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]coumarin Formula: C16H20NO3+ MolecularWeight: 274.3349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC(=O)OC3=C2C=C(C=C3)O

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC(=O)OC3=C2C=C(C=C3)O

InChI

InChI=1S/C16H19NO3/c1-11-4-6-17(7-5-11)10-12-8-16(19)20-15-3-2-13(18)9-14(12)15/h2-3,8-9,11,18H,4-7,10H2,1H3/p+1