4-(2-azanylethyl)phenol; N-(5-hexyl-2-oxidanyl-phenyl)methanamide

Systemtic Name: 4-(2-azanylethyl)phenol; N-(5-hexyl-2-oxidanyl-phenyl)methanamide Openeye Name: 4-(2-aminoethyl)phenol; N-(5-hexyl-2-hydroxy-phenyl)formamide CAS Name: 4-(2-aminoethyl)phenol; N-(5-hexyl-2-hydroxyphenyl)formamide IUPAC Name: 4-(2-aminoethyl)phenol; N-(5-hexyl-2-hydroxyphenyl)formamide Traditional Name: 4-(2-aminoethyl)phenol; N-(5-hexyl-2-hydroxy-phenyl)formamide Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)O)NC=O.C1=CC(=CC=C1CCN)O

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)O)NC=O.C1=CC(=CC=C1CCN)O

InChI

InChI=1S/C13H19NO2.C8H11NO/c1-2-3-4-5-6-11-7-8-13(16)12(9-11)14-10-15;9-6-5-7-1-3-8(10)4-2-7/h7-10,16H,2-6H2,1H3,(H,14,15);1-4,10H,5-6,9H2