4-[4-[4-(4-azanylphenoxy)phenyl]phenoxy]aniline hydrate

Systemtic Name: 4-[4-[4-(4-azanylphenoxy)phenyl]phenoxy]aniline hydrate Openeye Name: 4-[4-[4-(4-aminophenoxy)phenyl]phenoxy]aniline hydrate CAS Name: 4-[4-[4-(4-aminophenoxy)phenyl]phenoxy]aniline hydrate IUPAC Name: 4-[4-[4-(4-aminophenoxy)phenyl]phenoxy]aniline hydrate Traditional Name: [4-[4-[4-(4-aminophenoxy)phenyl]phenoxy]phenyl]amine hydrate Formula: C48H42N4O5 MolecularWeight: 754.87088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC=C(C=C3)N)OC4=CC=C(C=C4)N.C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC=C(C=C3)N)OC4=CC=C(C=C4)N.O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC=C(C=C3)N)OC4=CC=C(C=C4)N.C1=CC(=CC=C1C2=CC=C(C=C2)OC3=CC=C(C=C3)N)OC4=CC=C(C=C4)N.O

InChI

InChI=1S/2C24H20N2O2.H2O/c2*25-19-5-13-23(14-6-19)27-21-9-1-17(2-10-21)18-3-11-22(12-4-18)28-24-15-7-20(26)8-16-24;/h2*1-16H,25-26H2;1H2