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

Systemtic Name: 4-[(4R)-2-azanyl-3-cyano-6-methyl-5-oxidanylidene-4H-pyrano[3,2-c]quinolin-4-yl]benzoate Openeye Name: 4-[(4R)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]benzoate CAS Name: 4-[(4R)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]benzoate IUPAC Name: 4-[(4R)-2-amino-3-cyano-6-methyl-5-oxo-4H-pyrano[3,2-c]quinolin-4-yl]benzoate Traditional Name: 4-[(4R)-2-amino-3-cyano-5-keto-6-methyl-4H-pyrano[3,2-c]quinolin-4-yl]benzoate Formula: C21H14N3O4- MolecularWeight: 372.35356

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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)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H15N3O4/c1-24-15-5-3-2-4-13(15)18-17(20(24)25)16(14(10-22)19(23)28-18)11-6-8-12(9-7-11)21(26)27/h2-9,16H,23H2,1H3,(H,26,27)/p-1/t16-/m1/s1