4-methyl-6-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-3-olate

Systemtic Name: 4-methyl-6-oxidanylidene-2-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-3-olate Openeye Name: 4-methyl-6-oxo-2-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-3-olate CAS Name: 4-methyl-6-oxo-2-(1-piperidin-1-iumylmethyl)-3-benzo[c][1]benzopyranolate IUPAC Name: 4-methyl-6-oxo-2-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-3-olate Traditional Name: 6-keto-4-methyl-2-(piperidin-1-ium-1-ylmethyl)benzo[c]chromen-3-olate Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1[O-])C[NH+]3CCCCC3)C4=CC=CC=C4C(=O)O2

Isomeric SMILES

CC1=C2C(=CC(=C1[O-])C[NH+]3CCCCC3)C4=CC=CC=C4C(=O)O2

InChI

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