1-[2-(1-azanylethyl)phenyl]-3-butyl-urea

Systemtic Name: 1-[2-(1-azanylethyl)phenyl]-3-butyl-urea Openeye Name: 1-[2-(1-aminoethyl)phenyl]-3-butyl-urea CAS Name: 1-[2-(1-aminoethyl)phenyl]-3-butylurea IUPAC Name: 1-[2-(1-aminoethyl)phenyl]-3-butylurea Traditional Name: 1-[2-(1-aminoethyl)phenyl]-3-butyl-urea Formula: C13H21N3O MolecularWeight: 235.32534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=CC=C1C(C)N

Isomeric SMILES

CCCCNC(=O)NC1=CC=CC=C1C(C)N

InChI

InChI=1S/C13H21N3O/c1-3-4-9-15-13(17)16-12-8-6-5-7-11(12)10(2)14/h5-8,10H,3-4,9,14H2,1-2H3,(H2,15,16,17)