4-[(4-methylpiperidin-1-ium-1-yl)methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[(4-methylpiperidin-1-ium-1-yl)methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one CAS Name: 7-hydroxy-4-[(4-methyl-1-piperidin-1-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one Traditional Name: 7-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]coumarin Formula: C16H20NO3+ MolecularWeight: 274.3349

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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