3,4,8-trimethyl-7-oxidanyl-6-(piperidin-1-ium-1-ylmethyl)chromen-2-one

Systemtic Name: 3,4,8-trimethyl-7-oxidanyl-6-(piperidin-1-ium-1-ylmethyl)chromen-2-one Openeye Name: 7-hydroxy-3,4,8-trimethyl-6-(piperidin-1-ium-1-ylmethyl)chromen-2-one CAS Name: 7-hydroxy-3,4,8-trimethyl-6-(1-piperidin-1-iumylmethyl)-1-benzopyran-2-one IUPAC Name: 7-hydroxy-3,4,8-trimethyl-6-(piperidin-1-ium-1-ylmethyl)chromen-2-one Traditional Name: 7-hydroxy-3,4,8-trimethyl-6-(piperidin-1-ium-1-ylmethyl)coumarin Formula: C18H24NO3+ MolecularWeight: 302.38806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)C[NH+]3CCCCC3)O)C)C

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)C[NH+]3CCCCC3)O)C)C

InChI

InChI=1S/C18H23NO3/c1-11-12(2)18(21)22-17-13(3)16(20)14(9-15(11)17)10-19-7-5-4-6-8-19/h9,20H,4-8,10H2,1-3H3/p+1