2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-7-methyl-5-oxidanylidene-6-(oxolan-2-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3-bromanyl-4-methoxy-phenyl)-7-methyl-5-oxidanylidene-6-(oxolan-2-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile Openeye Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-7-methyl-5-oxo-6-(tetrahydrofuran-2-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile CAS Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-7-methyl-5-oxo-6-(2-oxolanylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile IUPAC Name: 2-amino-4-(3-bromo-4-methoxyphenyl)-7-methyl-5-oxo-6-(oxolan-2-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile Traditional Name: 2-amino-4-(3-bromo-4-methoxy-phenyl)-5-keto-7-methyl-6-(tetrahydrofurfuryl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile Formula: C22H22BrN3O4 MolecularWeight: 472.33178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OC)Br)C(=O)N1CC4CCCO4

Isomeric SMILES

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OC)Br)C(=O)N1CC4CCCO4

InChI

InChI=1S/C22H22BrN3O4/c1-12-8-18-20(22(27)26(12)11-14-4-3-7-29-14)19(15(10-24)21(25)30-18)13-5-6-17(28-2)16(23)9-13/h5-6,8-9,14,19H,3-4,7,11,25H2,1-2H3