4-[3,4-bis(azanyl)phenyl]benzene-1,2-diamine hydrate

Systemtic Name: 4-[3,4-bis(azanyl)phenyl]benzene-1,2-diamine hydrate Openeye Name: 4-(3,4-diaminophenyl)benzene-1,2-diamine hydrate CAS Name: 4-(3,4-diaminophenyl)benzene-1,2-diamine hydrate IUPAC Name: 4-(3,4-diaminophenyl)benzene-1,2-diamine hydrate Traditional Name: [2-amino-4-(3,4-diaminophenyl)phenyl]amine hydrate Formula: C24H30N8O MolecularWeight: 446.548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N.C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N.O

Isomeric SMILES

C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N.C1=CC(=C(C=C1C2=CC(=C(C=C2)N)N)N)N.O

InChI

InChI=1S/2C12H14N4.H2O/c2*13-9-3-1-7(5-11(9)15)8-2-4-10(14)12(16)6-8;/h2*1-6H,13-16H2;1H2