(phenylmethyl) (4R)-2-azanyl-4-(2-butoxyphenyl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carboxylate

Systemtic Name: (phenylmethyl) (4R)-2-azanyl-4-(2-butoxyphenyl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carboxylate Openeye Name: benzyl (4R)-2-amino-4-(2-butoxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylate CAS Name: (4R)-2-amino-4-(2-butoxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4R)-2-amino-4-(2-butoxyphenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylate Traditional Name: (4R)-2-amino-4-(2-butoxyphenyl)-5-keto-7-methyl-4H-pyrano[3,2-c]pyran-3-carboxylic acid benzyl ester Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C2C3=C(C=C(OC3=O)C)OC(=C2C(=O)OCC4=CC=CC=C4)N

Isomeric SMILES

CCCCOC1=CC=CC=C1[C@@H]2C3=C(C=C(OC3=O)C)OC(=C2C(=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C27H27NO6/c1-3-4-14-31-20-13-9-8-12-19(20)22-23-21(15-17(2)33-27(23)30)34-25(28)24(22)26(29)32-16-18-10-6-5-7-11-18/h5-13,15,22H,3-4,14,16,28H2,1-2H3/t22-/m1/s1