4-(3-azanylbutyl)-2-methoxy-phenol hydrate

Systemtic Name: 4-(3-azanylbutyl)-2-methoxy-phenol hydrate Openeye Name: 4-(3-aminobutyl)-2-methoxy-phenol hydrate CAS Name: 4-(3-aminobutyl)-2-methoxyphenol hydrate IUPAC Name: 4-(3-aminobutyl)-2-methoxyphenol hydrate Traditional Name: 4-(3-aminobutyl)-2-methoxy-phenol hydrate Formula: C11H19NO3 MolecularWeight: 213.27346

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=C(C=C1)O)OC)N.O

Isomeric SMILES

CC(CCC1=CC(=C(C=C1)O)OC)N.O

InChI

InChI=1S/C11H17NO2.H2O/c1-8(12)3-4-9-5-6-10(13)11(7-9)14-2;/h5-8,13H,3-4,12H2,1-2H3;1H2