1-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoyl]piperidine-4-carboxylate

Systemtic Name: 1-[2-[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoyl]piperidine-4-carboxylate Openeye Name: 1-[2-(3-benzyl-4,8-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[4,8-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxoethyl]-4-piperidinecarboxylate IUPAC Name: 1-[2-(3-benzyl-4,8-dimethyl-2-oxochromen-7-yl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-benzyl-2-keto-4,8-dimethyl-chromen-7-yl)oxyacetyl]isonipecotate Formula: C26H26NO6- MolecularWeight: 448.48774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)N3CCC(CC3)C(=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)N3CCC(CC3)C(=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C26H27NO6/c1-16-20-8-9-22(32-15-23(28)27-12-10-19(11-13-27)25(29)30)17(2)24(20)33-26(31)21(16)14-18-6-4-3-5-7-18/h3-9,19H,10-15H2,1-2H3,(H,29,30)/p-1