1-methyl-3-(5-pentyl-2-phenylmethoxy-phenyl)urea; 2-(4-phenylmethoxyphenyl)ethanamine

Systemtic Name: 1-methyl-3-(5-pentyl-2-phenylmethoxy-phenyl)urea; 2-(4-phenylmethoxyphenyl)ethanamine Openeye Name: 1-(2-benzyloxy-5-pentyl-phenyl)-3-methyl-urea; 2-(4-benzyloxyphenyl)ethanamine CAS Name: 1-methyl-3-(5-pentyl-2-phenylmethoxyphenyl)urea; 2-(4-phenylmethoxyphenyl)ethanamine IUPAC Name: 1-methyl-3-(5-pentyl-2-phenylmethoxyphenyl)urea; 2-(4-phenylmethoxyphenyl)ethanamine Traditional Name: 1-(5-amyl-2-benzoxy-phenyl)-3-methyl-urea; 2-(4-benzoxyphenyl)ethylamine Formula: C35H43N3O3 MolecularWeight: 553.73422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OCC2=CC=CC=C2)NC(=O)NC.C1=CC=C(C=C1)COC2=CC=C(C=C2)CCN

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OCC2=CC=CC=C2)NC(=O)NC.C1=CC=C(C=C1)COC2=CC=C(C=C2)CCN

InChI

InChI=1S/C20H26N2O2.C15H17NO/c1-3-4-6-9-16-12-13-19(18(14-16)22-20(23)21-2)24-15-17-10-7-5-8-11-17;16-11-10-13-6-8-15(9-7-13)17-12-14-4-2-1-3-5-14/h5,7-8,10-14H,3-4,6,9,15H2,1-2H3,(H2,21,22,23);1-9H,10-12,16H2