4,8-dimethyl-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4,8-dimethyl-6-[(4-methylpiperidin-1-ium-1-yl)methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4,8-dimethyl-6-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one CAS Name: 7-hydroxy-4,8-dimethyl-6-[(4-methyl-1-piperidin-1-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4,8-dimethyl-6-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one Traditional Name: 7-hydroxy-4,8-dimethyl-6-[(4-methylpiperidin-1-ium-1-yl)methyl]coumarin Formula: C18H24NO3+ MolecularWeight: 302.38806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(C(=C3C(=C2)C(=CC(=O)O3)C)C)O

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(C(=C3C(=C2)C(=CC(=O)O3)C)C)O

InChI

InChI=1S/C18H23NO3/c1-11-4-6-19(7-5-11)10-14-9-15-12(2)8-16(20)22-18(15)13(3)17(14)21/h8-9,11,21H,4-7,10H2,1-3H3/p+1