2-(4-butoxyphenyl)ethanamine; 5-pentyl-2-phenylmethoxy-aniline

Systemtic Name: 2-(4-butoxyphenyl)ethanamine; 5-pentyl-2-phenylmethoxy-aniline Openeye Name: 2-benzyloxy-5-pentyl-aniline; 2-(4-butoxyphenyl)ethanamine CAS Name: 2-(4-butoxyphenyl)ethanamine; 5-pentyl-2-phenylmethoxyaniline IUPAC Name: 2-(4-butoxyphenyl)ethanamine; 5-pentyl-2-phenylmethoxyaniline Traditional Name: (5-amyl-2-benzoxy-phenyl)amine; 2-(4-butoxyphenyl)ethylamine Formula: C30H42N2O2 MolecularWeight: 462.66668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OCC2=CC=CC=C2)N.CCCCOC1=CC=C(C=C1)CCN

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OCC2=CC=CC=C2)N.CCCCOC1=CC=C(C=C1)CCN

InChI

InChI=1S/C18H23NO.C12H19NO/c1-2-3-5-8-15-11-12-18(17(19)13-15)20-14-16-9-6-4-7-10-16;1-2-3-10-14-12-6-4-11(5-7-12)8-9-13/h4,6-7,9-13H,2-3,5,8,14,19H2,1H3;4-7H,2-3,8-10,13H2,1H3