N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]heptan-1-amine

Systemtic Name: N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]heptan-1-amine Openeye Name: N-[[3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]heptan-1-amine CAS Name: N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-1-heptanamine IUPAC Name: N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]heptan-1-amine Traditional Name: [3-ethoxy-4-(2-thenyloxy)benzyl]-heptyl-amine Formula: C21H31NO2S MolecularWeight: 361.54134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNCC1=CC(=C(C=C1)OCC2=CC=CS2)OCC

Isomeric SMILES

CCCCCCCNCC1=CC(=C(C=C1)OCC2=CC=CS2)OCC

InChI

InChI=1S/C21H31NO2S/c1-3-5-6-7-8-13-22-16-18-11-12-20(21(15-18)23-4-2)24-17-19-10-9-14-25-19/h9-12,14-15,22H,3-8,13,16-17H2,1-2H3