(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride

Systemtic Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride Openeye Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate hydrochloride CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrochloride IUPAC Name: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 3-methyl-4-oxo-2-phenylchromene-8-carboxylate hydrochloride Traditional Name: 4-keto-3-methyl-2-phenyl-chromene-8-carboxylic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester hydrochloride Formula: C25H26ClNO4 MolecularWeight: 439.93124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OC3CC4CCC(C3)N4C)C5=CC=CC=C5.Cl

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OC3CC4CCC(C3)N4C)C5=CC=CC=C5.Cl

InChI

InChI=1S/C25H25NO4.ClH/c1-15-22(27)20-9-6-10-21(24(20)30-23(15)16-7-4-3-5-8-16)25(28)29-19-13-17-11-12-18(14-19)26(17)2;/h3-10,17-19H,11-14H2,1-2H3;1H