2-[4-[(4R)-2-azanyl-3-cyano-6-methyl-5-oxidanylidene-4H-pyrano[3,2-c]quinolin-4-yl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(4R)-2-azanyl-3-cyano-6-methyl-5-oxidanylidene-4H-pyrano[3,2-c]quinolin-4-yl]phenoxy]ethanoate Openeye Name: 2-[4-[(4R)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]phenoxy]acetate CAS Name: 2-[4-[(4R)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]phenoxy]acetate IUPAC Name: 2-[4-[(4R)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]phenoxy]acetate Traditional Name: 2-[4-[(4R)-2-amino-3-cyano-5-keto-6-methyl-4H-pyrano[3,2-c]quinolin-4-yl]phenoxy]acetate Formula: C22H16N3O5- MolecularWeight: 402.37954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C(C1=O)C(C(=C(O3)N)C#N)C4=CC=C(C=C4)OCC(=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2C3=C(C1=O)[C@@H](C(=C(O3)N)C#N)C4=CC=C(C=C4)OCC(=O)[O-]

InChI

InChI=1S/C22H17N3O5/c1-25-16-5-3-2-4-14(16)20-19(22(25)28)18(15(10-23)21(24)30-20)12-6-8-13(9-7-12)29-11-17(26)27/h2-9,18H,11,24H2,1H3,(H,26,27)/p-1/t18-/m1/s1