1-(3-methoxyphenyl)ethanamine; 1-methyl-3-(3-pentylphenyl)urea

Systemtic Name: 1-(3-methoxyphenyl)ethanamine; 1-methyl-3-(3-pentylphenyl)urea Openeye Name: 1-(3-methoxyphenyl)ethanamine; 1-methyl-3-(3-pentylphenyl)urea CAS Name: 1-(3-methoxyphenyl)ethanamine; 1-methyl-3-(3-pentylphenyl)urea IUPAC Name: 1-(3-methoxyphenyl)ethanamine; 1-methyl-3-(3-pentylphenyl)urea Traditional Name: 1-(3-amylphenyl)-3-methyl-urea; 1-(3-methoxyphenyl)ethylamine Formula: C22H33N3O2 MolecularWeight: 371.51632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=CC=C1)NC(=O)NC.CC(C1=CC(=CC=C1)OC)N

Isomeric SMILES

CCCCCC1=CC(=CC=C1)NC(=O)NC.CC(C1=CC(=CC=C1)OC)N

InChI

InChI=1S/C13H20N2O.C9H13NO/c1-3-4-5-7-11-8-6-9-12(10-11)15-13(16)14-2;1-7(10)8-4-3-5-9(6-8)11-2/h6,8-10H,3-5,7H2,1-2H3,(H2,14,15,16);3-7H,10H2,1-2H3