4-[[4-[(4-bromophenyl)methoxy]-3-iodanyl-5-methoxy-phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[4-[(4-bromophenyl)methoxy]-3-iodanyl-5-methoxy-phenyl]methylideneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[4-[(4-bromophenyl)methoxy]-3-iodo-5-methoxy-phenyl]methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[4-[(4-bromophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylideneamino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[4-[(4-bromophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[4-(4-bromobenzyl)oxy-3-iodo-5-methoxy-benzylidene]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C26H23BrIN3O3 MolecularWeight: 632.28759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C(=C3)I)OCC4=CC=C(C=C4)Br)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C(=C3)I)OCC4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C26H23BrIN3O3/c1-17-24(26(32)31(30(17)2)21-7-5-4-6-8-21)29-15-19-13-22(28)25(23(14-19)33-3)34-16-18-9-11-20(27)12-10-18/h4-15H,16H2,1-3H3