(4R)-6-azanyl-4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: (4R)-6-azanyl-4-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: (4R)-6-amino-4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: (4R)-6-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: (4R)-6-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: (4R)-6-amino-4-(3-bromo-4-hydroxy-5-methoxy-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C17H17BrN4O3 MolecularWeight: 405.24588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)Br)O)OC

Isomeric SMILES

CCCC1=C2[C@@H](C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)Br)O)OC

InChI

InChI=1S/C17H17BrN4O3/c1-3-4-11-14-13(8-5-10(18)15(23)12(6-8)24-2)9(7-19)16(20)25-17(14)22-21-11/h5-6,13,23H,3-4,20H2,1-2H3,(H,21,22)/t13-/m1/s1