1-[3-(aminomethyl)phenyl]-3-pentan-3-yl-urea

Systemtic Name: 1-[3-(aminomethyl)phenyl]-3-pentan-3-yl-urea Openeye Name: 1-[3-(aminomethyl)phenyl]-3-(1-ethylpropyl)urea CAS Name: 1-[3-(aminomethyl)phenyl]-3-pentan-3-ylurea IUPAC Name: 1-[3-(aminomethyl)phenyl]-3-pentan-3-ylurea Traditional Name: 1-[3-(aminomethyl)phenyl]-3-(1-ethylpropyl)urea Formula: C13H21N3O MolecularWeight: 235.32534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)NC1=CC=CC(=C1)CN

Isomeric SMILES

CCC(CC)NC(=O)NC1=CC=CC(=C1)CN

InChI

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