N-(2-oxidanyl-5-pentyl-phenyl)methanamide; 2-phenylethanamine

Systemtic Name: N-(2-oxidanyl-5-pentyl-phenyl)methanamide; 2-phenylethanamine Openeye Name: N-(2-hydroxy-5-pentyl-phenyl)formamide; 2-phenylethanamine CAS Name: N-(2-hydroxy-5-pentylphenyl)formamide; 2-phenylethanamine IUPAC Name: N-(2-hydroxy-5-pentylphenyl)formamide; 2-phenylethanamine Traditional Name: N-(5-amyl-2-hydroxy-phenyl)formamide; phenethylamine Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)O)NC=O.C1=CC=C(C=C1)CCN

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)O)NC=O.C1=CC=C(C=C1)CCN

InChI

InChI=1S/C12H17NO2.C8H11N/c1-2-3-4-5-10-6-7-12(15)11(8-10)13-9-14;9-7-6-8-4-2-1-3-5-8/h6-9,15H,2-5H2,1H3,(H,13,14);1-5H,6-7,9H2