(6-methyl-7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-8-yl)methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: (6-methyl-7-oxidanyl-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-8-yl)methyl-(pyridin-4-ylmethyl)azanium Openeye Name: (7-hydroxy-6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-8-yl)methyl-(4-pyridylmethyl)ammonium CAS Name: (7-hydroxy-6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-8-yl)methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: (7-hydroxy-6-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-8-yl)methyl-(pyridin-4-ylmethyl)azanium Traditional Name: (7-hydroxy-4-keto-6-methyl-2,3-dihydro-1H-cyclopenta[c]chromen-8-yl)methyl-(4-pyridylmethyl)ammonium Formula: C20H21N2O3+ MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)C[NH2+]CC3=CC=NC=C3)C4=C(CCC4)C(=O)O2

Isomeric SMILES

CC1=C2C(=CC(=C1O)C[NH2+]CC3=CC=NC=C3)C4=C(CCC4)C(=O)O2

InChI

InChI=1S/C20H20N2O3/c1-12-18(23)14(11-22-10-13-5-7-21-8-6-13)9-17-15-3-2-4-16(15)20(24)25-19(12)17/h5-9,22-23H,2-4,10-11H2,1H3/p+1