6-methyl-7-oxidanyl-8-(pyrrolidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one

Systemtic Name: 6-methyl-7-oxidanyl-8-(pyrrolidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Openeye Name: 7-hydroxy-6-methyl-8-(pyrrolidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one CAS Name: 7-hydroxy-6-methyl-8-(1-pyrrolidin-1-iumylmethyl)-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-4-one IUPAC Name: 7-hydroxy-6-methyl-8-(pyrrolidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Traditional Name: 7-hydroxy-6-methyl-8-(pyrrolidin-1-ium-1-ylmethyl)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Formula: C18H22NO3+ MolecularWeight: 300.37218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)C[NH+]3CCCC3)C4=C(CCC4)C(=O)O2

Isomeric SMILES

CC1=C2C(=CC(=C1O)C[NH+]3CCCC3)C4=C(CCC4)C(=O)O2

InChI

InChI=1S/C18H21NO3/c1-11-16(20)12(10-19-7-2-3-8-19)9-15-13-5-4-6-14(13)18(21)22-17(11)15/h9,20H,2-8,10H2,1H3/p+1