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

Systemtic Name: 6-chloranyl-7-methyl-4-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one Openeye Name: 6-chloro-7-methyl-4-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one CAS Name: 6-chloro-7-methyl-4-[(4-methyl-1-piperidin-1-iumyl)methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-[(4-methylpiperidin-1-ium-1-yl)methyl]chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[(4-methylpiperidin-1-ium-1-yl)methyl]coumarin Formula: C17H21ClNO2+ MolecularWeight: 306.80714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

InChI

InChI=1S/C17H20ClNO2/c1-11-3-5-19(6-4-11)10-13-8-17(20)21-16-7-12(2)15(18)9-14(13)16/h7-9,11H,3-6,10H2,1-2H3/p+1