6-chloranyl-3,4-dimethyl-2-oxidanylidene-8-[[(2,2,6,6-tetramethylpiperidin-4-yl)azaniumyl]methyl]chromen-7-olate

Systemtic Name: 6-chloranyl-3,4-dimethyl-2-oxidanylidene-8-[[(2,2,6,6-tetramethylpiperidin-4-yl)azaniumyl]methyl]chromen-7-olate Openeye Name: 6-chloro-3,4-dimethyl-2-oxo-8-[[(2,2,6,6-tetramethyl-4-piperidyl)ammonio]methyl]chromen-7-olate CAS Name: 6-chloro-3,4-dimethyl-2-oxo-8-[[(2,2,6,6-tetramethyl-4-piperidinyl)ammonio]methyl]-1-benzopyran-7-olate IUPAC Name: 6-chloro-3,4-dimethyl-2-oxo-8-[[(2,2,6,6-tetramethylpiperidin-4-yl)azaniumyl]methyl]chromen-7-olate Traditional Name: 6-chloro-2-keto-3,4-dimethyl-8-[[(2,2,6,6-tetramethyl-4-piperidyl)ammonio]methyl]chromen-7-olate Formula: C21H29ClN2O3 MolecularWeight: 392.91956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CC(NC(C3)(C)C)(C)C)C

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CC(NC(C3)(C)C)(C)C)C

InChI

InChI=1S/C21H29ClN2O3/c1-11-12(2)19(26)27-18-14(11)7-16(22)17(25)15(18)10-23-13-8-20(3,4)24-21(5,6)9-13/h7,13,23-25H,8-10H2,1-6H3