(4S)-2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-6-methyl-5-oxidanylidene-4H-pyrano[3,2-c]quinoline-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-4-(3-bromanyl-4,5-dimethoxy-phenyl)-6-methyl-5-oxidanylidene-4H-pyrano[3,2-c]quinoline-3-carbonitrile Openeye Name: (4S)-2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-6-methyl-5-oxo-4H-pyrano[3,2-c]quinoline-3-carbonitrile CAS Name: (4S)-2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-6-methyl-5-oxo-4H-pyrano[3,2-c]quinoline-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(3-bromo-4,5-dimethoxyphenyl)-6-methyl-5-oxo-4H-pyrano[3,2-c]quinoline-3-carbonitrile Traditional Name: (4S)-2-amino-4-(3-bromo-4,5-dimethoxy-phenyl)-5-keto-6-methyl-4H-pyrano[3,2-c]quinoline-3-carbonitrile Formula: C22H18BrN3O4 MolecularWeight: 468.30002

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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)Br)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H18BrN3O4/c1-26-15-7-5-4-6-12(15)19-18(22(26)27)17(13(10-24)21(25)30-19)11-8-14(23)20(29-3)16(9-11)28-2/h4-9,17H,25H2,1-3H3/t17-/m0/s1