2-(4-butoxyphenyl)ethanamine; 3-pentylaniline

Systemtic Name: 2-(4-butoxyphenyl)ethanamine; 3-pentylaniline Openeye Name: 2-(4-butoxyphenyl)ethanamine; 3-pentylaniline CAS Name: 2-(4-butoxyphenyl)ethanamine; 3-pentylaniline IUPAC Name: 2-(4-butoxyphenyl)ethanamine; 3-pentylaniline Traditional Name: (3-amylphenyl)amine; 2-(4-butoxyphenyl)ethylamine Formula: C23H36N2O MolecularWeight: 356.54474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=CC=C1)N.CCCCOC1=CC=C(C=C1)CCN

Isomeric SMILES

CCCCCC1=CC(=CC=C1)N.CCCCOC1=CC=C(C=C1)CCN

InChI

InChI=1S/C12H19NO.C11H17N/c1-2-3-10-14-12-6-4-11(5-7-12)8-9-13;1-2-3-4-6-10-7-5-8-11(12)9-10/h4-7H,2-3,8-10,13H2,1H3;5,7-9H,2-4,6,12H2,1H3