3-[3,6-bis(azanyl)-2-(phenylazanylmethyl)phenyl]propane-1,1-diol

Systemtic Name: 3-[3,6-bis(azanyl)-2-(phenylazanylmethyl)phenyl]propane-1,1-diol Openeye Name: 3-[3,6-diamino-2-(anilinomethyl)phenyl]propane-1,1-diol CAS Name: 3-[3,6-diamino-2-(anilinomethyl)phenyl]propane-1,1-diol IUPAC Name: 3-[3,6-diamino-2-(anilinomethyl)phenyl]propane-1,1-diol Traditional Name: 3-[3,6-diamino-2-(anilinomethyl)phenyl]propane-1,1-diol Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC2=C(C=CC(=C2CCC(O)O)N)N

Isomeric SMILES

C1=CC=C(C=C1)NCC2=C(C=CC(=C2CCC(O)O)N)N

InChI

InChI=1S/C16H21N3O2/c17-14-7-8-15(18)13(12(14)6-9-16(20)21)10-19-11-4-2-1-3-5-11/h1-5,7-8,16,19-21H,6,9-10,17-18H2