6-azanyl-4-(3-bromanyl-2-chloranyl-5-methoxy-4-oxidanyl-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-4-(3-bromanyl-2-chloranyl-5-methoxy-4-oxidanyl-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(3-bromo-2-chloro-4-hydroxy-5-methoxy-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-4-(3-bromo-2-chloro-4-hydroxy-5-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-4-(3-bromo-2-chloro-4-hydroxy-5-methoxyphenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(3-bromo-2-chloro-4-hydroxy-5-methoxy-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H16BrClN4O3 MolecularWeight: 487.73374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3Cl)Br)O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3Cl)Br)O)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H16BrClN4O3/c1-10-15-16(12-8-14(29-2)19(28)17(22)18(12)23)13(9-24)20(25)30-21(15)27(26-10)11-6-4-3-5-7-11/h3-8,16,28H,25H2,1-2H3