1-methyl-3-oxidanyl-4-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-6-one

Systemtic Name: 1-methyl-3-oxidanyl-4-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-6-one Openeye Name: 3-hydroxy-1-methyl-4-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-6-one CAS Name: 3-hydroxy-1-methyl-4-(1-piperidin-1-iumylmethyl)-6-benzo[c][1]benzopyranone IUPAC Name: 3-hydroxy-1-methyl-4-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-6-one Traditional Name: 3-hydroxy-1-methyl-4-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-6-one Formula: C20H22NO3+ MolecularWeight: 324.39358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C3=CC=CC=C3C(=O)O2)C[NH+]4CCCCC4)O

Isomeric SMILES

CC1=CC(=C(C2=C1C3=CC=CC=C3C(=O)O2)C[NH+]4CCCCC4)O

InChI

InChI=1S/C20H21NO3/c1-13-11-17(22)16(12-21-9-5-2-6-10-21)19-18(13)14-7-3-4-8-15(14)20(23)24-19/h3-4,7-8,11,22H,2,5-6,9-10,12H2,1H3/p+1