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

Systemtic Name: 6-azanyl-1-(4-bromophenyl)-4-(3-methoxy-4-phenylmethoxy-phenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-4-(4-benzyloxy-3-methoxy-phenyl)-1-(4-bromophenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-1-(4-bromophenyl)-4-(3-methoxy-4-phenylmethoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-1-(4-bromophenyl)-4-(3-methoxy-4-phenylmethoxyphenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-4-(4-benzoxy-3-methoxy-phenyl)-1-(4-bromophenyl)-3-methyl-6H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C28H23BrN4O3 MolecularWeight: 543.41122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=NN(C2=C1C(=C(C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C5=CC=C(C=C5)Br

InChI

InChI=1S/C28H23BrN4O3/c1-17-25-26(19-8-13-23(24(14-19)34-2)35-16-18-6-4-3-5-7-18)22(15-30)27(31)36-28(25)33(32-17)21-11-9-20(29)10-12-21/h3-14,27H,16,31H2,1-2H3