1-(4-azanyl-3-methyl-phenyl)azepane-3,6-diol

Systemtic Name: 1-(4-azanyl-3-methyl-phenyl)azepane-3,6-diol Openeye Name: 1-(4-amino-3-methyl-phenyl)azepane-3,6-diol CAS Name: 1-(4-amino-3-methylphenyl)azepane-3,6-diol IUPAC Name: 1-(4-amino-3-methylphenyl)azepane-3,6-diol Traditional Name: 1-(4-amino-3-methyl-phenyl)azepane-3,6-diol Formula: C13H20N2O2 MolecularWeight: 236.3101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC(CCC(C2)O)O)N

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC(CCC(C2)O)O)N

InChI

InChI=1S/C13H20N2O2/c1-9-6-10(2-5-13(9)14)15-7-11(16)3-4-12(17)8-15/h2,5-6,11-12,16-17H,3-4,7-8,14H2,1H3