3-methyl-N-phenyl-octanamide; 2-phenylethanamine

Systemtic Name: 3-methyl-N-phenyl-octanamide; 2-phenylethanamine Openeye Name: 3-methyl-N-phenyl-octanamide; 2-phenylethanamine CAS Name: 3-methyl-N-phenyloctanamide; 2-phenylethanamine IUPAC Name: 3-methyl-N-phenyloctanamide; 2-phenylethanamine Traditional Name: 3-methyl-N-phenyl-caprylamide; phenethylamine Formula: C23H34N2O MolecularWeight: 354.52886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CC(=O)NC1=CC=CC=C1.C1=CC=C(C=C1)CCN

Isomeric SMILES

CCCCCC(C)CC(=O)NC1=CC=CC=C1.C1=CC=C(C=C1)CCN

InChI

InChI=1S/C15H23NO.C8H11N/c1-3-4-6-9-13(2)12-15(17)16-14-10-7-5-8-11-14;9-7-6-8-4-2-1-3-5-8/h5,7-8,10-11,13H,3-4,6,9,12H2,1-2H3,(H,16,17);1-5H,6-7,9H2